![0I6 0I6](https://data.pdbj.org/pdbjplus/data/cc/svg/0I6.svg) | 0I6 | Name: | 4-[(2R)-2-oxidanyl-3-(3,4,5-trimethylphenyl)tellanyl-propyl]selanylbenzenesulfonamide | Formula: | C18 H23 N O6 S Se Te | SMILES: | COc1cc([Te]C[CH](O)C[Se]c2ccc(cc2)[S](N)(=O)=O)cc(OC)c1OC | InChi: | InChI=1S/C18H23NO6SSeTe/c1-23-16-8-15(9-17(24-2)18(16)25-3)28-11-12(20)10-27-14-6-4-13(5-7-14)26(19,21)22/h4-9,12,20H,10-11H2,1-3H3,(H2,19,21,22)/t12-/m1/s1 | Synonyms: | 4-((3-(butylselanyl)-2-hydroxypropyl)selanyl)benzenesulfonamide | Definition date: | 2021-06-07 | Last modified: | 2022-08-22 | Release date: | 2022-06-22 | Identifier: | 4-[(2~{R})-2-oxidanyl-3-(3,4,5-trimethoxyphenyl)tellanyl-propyl]selanylbenzenesulfonamide |
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![KFR KFR](https://data.pdbj.org/pdbjplus/data/cc/svg/KFR.svg) | KFR | Name: | methyl (2S)-2-[[(2S)-2-[[(2S,3R)-3-azanyl-2-oxidanyl-4-(4-oxidanylphenoxy)butanoyl]amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoate | Formula: | C28 H36 N4 O7 | SMILES: | COC(=O)[CH](Cc1c[nH]c2ccccc12)NC(=O)[CH](CC(C)C)NC(=O)[CH](O)[CH](N)COc3ccc(O)cc3 | InChi: | InChI=1S/C28H36N4O7/c1-16(2)12-23(31-27(36)25(34)21(29)15-39-19-10-8-18(33)9-11-19)26(35)32-24(28(37)38-3)13-17-14-30-22-7-5-4-6-20(17)22/h4-11,14,16,21,23-25,30,33-34H,12-13,15,29H2,1-3H3,(H,31,36)(H,32,35)/t21-,23+,24+,25+/m1/s1 | Synonyms: | (2S-3R)-3-Amino-2-Hydroxybutyryl derivative | Definition date: | 2022-05-25 | Last modified: | 2022-08-22 | Release date: | 2022-07-20 | Identifier: | methyl (2~{S})-2-[[(2~{S})-2-[[(2~{S},3~{R})-3-azanyl-2-oxidanyl-4-(4-oxidanylphenoxy)butanoyl]amino]-4-methyl-pentanoyl]amino]-3-(1~{H}-indol-3-yl)propanoate |
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![KMC KMC](https://data.pdbj.org/pdbjplus/data/cc/svg/KMC.svg) | KMC | Name: | galangin | Formula: | C15 H10 O5 | SMILES: | Oc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccccc3)O | InChi: | InChI=1S/C15H10O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,16-17,19H | Synonyms: | 3,5,7-tris(oxidanyl)-2-phenyl-chromen-4-one | Definition date: | 2022-05-31 | Last modified: | 2022-08-22 | Release date: | 2022-07-20 | Identifier: | 3,5,7-tris(oxidanyl)-2-phenyl-chromen-4-one |
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![KML KML](https://data.pdbj.org/pdbjplus/data/cc/svg/KML.svg) | KML | Name: | pinocembrin | Formula: | C15 H12 O4 | SMILES: | Oc1cc(O)c2C(=O)C[CH](Oc2c1)c3ccccc3 | InChi: | InChI=1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2/t13-/m0/s1 | Synonyms: | (2~{S})-5,7-bis(oxidanyl)-2-phenyl-2,3-dihydrochromen-4-one | Definition date: | 2022-05-31 | Last modified: | 2022-08-22 | Release date: | 2022-07-20 | Identifier: | (2~{S})-5,7-bis(oxidanyl)-2-phenyl-2,3-dihydrochromen-4-one |
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![KMU KMU](https://data.pdbj.org/pdbjplus/data/cc/svg/KMU.svg) | KMU | Name: | 2-[(2~{S})-2-(aminomethyl)-5-chloranyl-2-phenyl-3~{H}-1-benzofuran-4-yl]benzamide | Formula: | C22 H19 Cl N2 O2 | SMILES: | NC[C]1(Cc2c(O1)ccc(Cl)c2c3ccccc3C(N)=O)c4ccccc4 | InChi: | InChI=1S/C22H19ClN2O2/c23-18-10-11-19-17(20(18)15-8-4-5-9-16(15)21(25)26)12-22(13-24,27-19)14-6-2-1-3-7-14/h1-11H,12-13,24H2,(H2,25,26)/t22-/m1/s1 | Definition date: | 2022-05-31 | Last modified: | 2022-08-22 | Release date: | 2022-08-17 | Identifier: | 2-[(2~{S})-2-(aminomethyl)-5-chloranyl-2-phenyl-3~{H}-1-benzofuran-4-yl]benzamide |
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![KNE KNE](https://data.pdbj.org/pdbjplus/data/cc/svg/KNE.svg) | KNE | Name: | [(2~{S})-5-chloranyl-2-phenyl-3~{H}-1-benzofuran-2-yl]methanamine | Formula: | C15 H14 Cl N O | SMILES: | NC[C]1(Cc2cc(Cl)ccc2O1)c3ccccc3 | InChi: | InChI=1S/C15H14ClNO/c16-13-6-7-14-11(8-13)9-15(10-17,18-14)12-4-2-1-3-5-12/h1-8H,9-10,17H2/t15-/m1/s1 | Definition date: | 2022-05-31 | Last modified: | 2022-08-22 | Release date: | 2022-08-17 | Identifier: | [(2~{S})-5-chloranyl-2-phenyl-3~{H}-1-benzofuran-2-yl]methanamine |
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![KNR KNR](https://data.pdbj.org/pdbjplus/data/cc/svg/KNR.svg) | KNR | Name: | 1-[(8~{R},15~{S},18~{S})-18-(4-azanylbutyl)-15-butyl-4,7,14,17,20-pentakis(oxidanylidene)-3,6,13,16,19-pentazabicyclo[20.3.1]hexacosa-1(26),22,24-trien-8-yl]guanidine | Formula: | C30 H49 N9 O5 | SMILES: | CCCC[CH]1NC(=O)[CH](CCCCN)NC(=O)Cc2cccc(CNC(=O)CNC(=O)[CH](CCCCNC1=O)NC(N)=N)c2 | InChi: | InChI=1S/C30H49N9O5/c1-2-3-11-22-27(42)34-15-7-5-13-23(39-30(32)33)28(43)36-19-26(41)35-18-21-10-8-9-20(16-21)17-25(40)37-24(29(44)38-22)12-4-6-14-31/h8-10,16,22-24H,2-7,11-15,17-19,31H2,1H3,(H,34,42)(H,35,41)(H,36,43)(H,37,40)(H,38,44)(H4,32,33,39)/t22-,23+,24-/m0/s1 | Definition date: | 2022-05-31 | Last modified: | 2022-08-22 | Release date: | 2022-07-13 | Identifier: | 1-[(8~{R},15~{S},18~{S})-18-(4-azanylbutyl)-15-butyl-4,7,14,17,20-pentakis(oxidanylidene)-3,6,13,16,19-pentazabicyclo[20.3.1]hexacosa-1(26),22,24-trien-8-yl]guanidine |
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![KQU KQU](https://data.pdbj.org/pdbjplus/data/cc/svg/KQU.svg) | KQU | Name: | 4-[(2R)-3-butylselanyl-2-oxidanyl-propyl]selanylbenzenesulfonamide | Formula: | C13 H21 N O3 S Se2 | SMILES: | CCCC[Se]C[CH](O)C[Se]c1ccc(cc1)[S](N)(=O)=O | InChi: | InChI=1S/C13H21NO3SSe2/c1-2-3-8-19-9-11(15)10-20-13-6-4-12(5-7-13)18(14,16)17/h4-7,11,15H,2-3,8-10H2,1H3,(H2,14,16,17)/t11-/m1/s1 | Synonyms: | 4-((3-(butylselanyl)-2-hydroxypropyl)selanyl)benzenesulfonamide | Definition date: | 2022-06-06 | Last modified: | 2022-08-22 | Release date: | 2022-06-22 | Identifier: | 4-[(2~{R})-3-butylselanyl-2-oxidanyl-propyl]selanylbenzenesulfonamide |
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![KR6 KR6](https://data.pdbj.org/pdbjplus/data/cc/svg/KR6.svg) | KR6 | Name: | 4-[(2S)-3-butylselanyl-2-oxidanyl-propyl]selanylbenzenesulfonamide | Formula: | C13 H21 N O3 S Se2 | SMILES: | CCCC[Se]C[CH](O)C[Se]c1ccc(cc1)[S](N)(=O)=O | InChi: | InChI=1S/C13H21NO3SSe2/c1-2-3-8-19-9-11(15)10-20-13-6-4-12(5-7-13)18(14,16)17/h4-7,11,15H,2-3,8-10H2,1H3,(H2,14,16,17)/t11-/m0/s1 | Definition date: | 2022-06-06 | Last modified: | 2022-08-22 | Release date: | 2022-06-22 | Identifier: | 4-[(2~{S})-3-butylselanyl-2-oxidanyl-propyl]selanylbenzenesulfonamide |
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![RCT RCT](https://data.pdbj.org/pdbjplus/data/cc/svg/RCT.svg) | RCT | Name: | 4-(3-chloro-2-phenethylphenyl)-1H-1,2,3-triazole | Formula: | C16 H14 Cl N3 | SMILES: | Clc1cccc(c2[nH]nnc2)c1CCc3ccccc3 | InChi: | InChI=1S/C16H14ClN3/c17-15-8-4-7-14(16-11-18-20-19-16)13(15)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H,18,19,20) | Synonyms: | MMG-0472 | Definition date: | 2020-09-24 | Last modified: | 2022-08-22 | Release date: | 2022-07-06 | Identifier: | 5-[3-chloranyl-2-(2-phenylethyl)phenyl]-1~{H}-1,2,3-triazole |
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![9P0 9P0](https://data.pdbj.org/pdbjplus/data/cc/svg/9P0.svg) | 9P0 | Name: | 4-[(5S,8R)-5-(dimethylcarbamoyl)-8-[[(2S)-1-ethanoylpyrrolidin-2-yl]carbonylamino]-7,11-bis(oxidanylidene)-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-trien-16-yl]benzoic acid | Formula: | C30 H34 N4 O8 S | SMILES: | CN(C)C(=O)[CH]1CSCc2c(cccc2c3ccc(cc3)C(O)=O)C(=O)OC[CH](NC(=O)[CH]4CCCN4C(C)=O)C(=O)N1 | InChi: | InChI=1S/C30H34N4O8S/c1-17(35)34-13-5-8-25(34)27(37)31-23-14-42-30(41)21-7-4-6-20(18-9-11-19(12-10-18)29(39)40)22(21)15-43-16-24(32-26(23)36)28(38)33(2)3/h4,6-7,9-12,23-25H,5,8,13-16H2,1-3H3,(H,31,37)(H,32,36)(H,39,40)/t23-,24-,25+/m1/s1 | Definition date: | 2021-11-19 | Last modified: | 2022-08-22 | Release date: | 2022-03-16 | Identifier: | 4-[(5~{S},8~{R})-5-(dimethylcarbamoyl)-8-[[(2~{S})-1-ethanoylpyrrolidin-2-yl]carbonylamino]-7,11-bis(oxidanylidene)-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-trien-16-yl]benzoic acid |
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![9SI 9SI](https://data.pdbj.org/pdbjplus/data/cc/svg/9SI.svg) | 9SI | Name: | [(2R,3S,4R,5R)-5-[1-[[4-(aminomethyl)phenyl]methyl]-6-azanyl-purin-1-ium-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate | Formula: | C18 H24 N6 O7 P | SMILES: | NCc1ccc(C[n+]2cnc3n(cnc3c2N)[CH]4O[CH](CO[P](O)(O)=O)[CH](O)[CH]4O)cc1 | InChi: | InChI=1S/C18H23N6O7P/c19-5-10-1-3-11(4-2-10)6-23-8-22-17-13(16(23)20)21-9-24(17)18-15(26)14(25)12(31-18)7-30-32(27,28)29/h1-4,8-9,12,14-15,18,20,25-26H,5-7,19H2,(H2,27,28,29)/p+1/t12-,14-,15-,18-/m1/s1 | Synonyms: | 1-benzylamine-adenosine | Definition date: | 2021-11-19 | Last modified: | 2022-08-22 | Release date: | 2022-03-23 | Identifier: | [(2~{R},3~{S},4~{R},5~{R})-5-[1-[[4-(aminomethyl)phenyl]methyl]-6-azanyl-purin-1-ium-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate |
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![9SY 9SY](https://data.pdbj.org/pdbjplus/data/cc/svg/9SY.svg) | 9SY | Name: | [(2R,3S,4R,5R)-5-[6-azanyl-1-(phenylmethyl)purin-1-ium-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate | Formula: | C17 H21 N5 O7 P | SMILES: | Nc1c2ncn([CH]3O[CH](CO[P](O)(O)=O)[CH](O)[CH]3O)c2nc[n+]1Cc4ccccc4 | InChi: | InChI=1S/C17H20N5O7P/c18-15-12-16(20-8-21(15)6-10-4-2-1-3-5-10)22(9-19-12)17-14(24)13(23)11(29-17)7-28-30(25,26)27/h1-5,8-9,11,13-14,17-18,23-24H,6-7H2,(H2,25,26,27)/p+1/t11-,13-,14-,17-/m1/s1 | Synonyms: | 1-benzyl-adenosine derivative | Definition date: | 2021-11-19 | Last modified: | 2022-08-22 | Release date: | 2022-03-23 | Identifier: | [(2~{R},3~{S},4~{R},5~{R})-5-[6-azanyl-1-(phenylmethyl)purin-1-ium-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate |
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![9TI 9TI](https://data.pdbj.org/pdbjplus/data/cc/svg/9TI.svg) | 9TI | Name: | 2-methyl-3-(1~{H}-pyrazol-5-yl)imidazo[1,2-a]pyridine | Formula: | C11 H10 N4 | SMILES: | Cc1nc2ccccn2c1c3[nH]ncc3 | InChi: | InChI=1S/C11H10N4/c1-8-11(9-5-6-12-14-9)15-7-3-2-4-10(15)13-8/h2-7H,1H3,(H,12,14) | Definition date: | 2021-11-19 | Last modified: | 2022-08-22 | Release date: | 2022-01-19 | Identifier: | 2-methyl-3-(1~{H}-pyrazol-5-yl)imidazo[1,2-a]pyridine |
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![9V3 9V3](https://data.pdbj.org/pdbjplus/data/cc/svg/9V3.svg) | 9V3 | Name: | 2-(2-methylpropylamino)-1-[(4R)-4-(6-methylpyridin-2-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone | Formula: | C19 H25 N3 O S | SMILES: | CC(C)CNCC(=O)N1CCc2sccc2[CH]1c3cccc(C)n3 | InChi: | InChI=1S/C19H25N3OS/c1-13(2)11-20-12-18(23)22-9-7-17-15(8-10-24-17)19(22)16-6-4-5-14(3)21-16/h4-6,8,10,13,19-20H,7,9,11-12H2,1-3H3/t19-/m1/s1 | Definition date: | 2021-11-19 | Last modified: | 2022-08-22 | Release date: | 2022-01-26 | Identifier: | 2-(2-methylpropylamino)-1-[(4~{R})-4-(6-methylpyridin-2-yl)-6,7-dihydro-4~{H}-thieno[3,2-c]pyridin-5-yl]ethanone |
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![9VO 9VO](https://data.pdbj.org/pdbjplus/data/cc/svg/9VO.svg) | 9VO | Name: | N-(phenylmethyl)pyridin-2-amine | Formula: | C12 H12 N2 | SMILES: | C(Nc1ccccn1)c2ccccc2 | InChi: | InChI=1S/C12H12N2/c1-2-6-11(7-3-1)10-14-12-8-4-5-9-13-12/h1-9H,10H2,(H,13,14) | Definition date: | 2021-11-22 | Last modified: | 2022-08-22 | Release date: | 2022-01-26 | Identifier: | ~{N}-(phenylmethyl)pyridin-2-amine |
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![9WQ 9WQ](https://data.pdbj.org/pdbjplus/data/cc/svg/9WQ.svg) | 9WQ | Name: | 3-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-6-phenoxy-phthalazine-1-carboxylic acid | Formula: | C22 H14 Cl2 N2 O4 | SMILES: | OC(=O)C1=NN(Cc2ccc(Cl)c(Cl)c2)C(=O)c3cc(Oc4ccccc4)ccc13 | InChi: | InChI=1S/C22H14Cl2N2O4/c23-18-9-6-13(10-19(18)24)12-26-21(27)17-11-15(30-14-4-2-1-3-5-14)7-8-16(17)20(25-26)22(28)29/h1-11H,12H2,(H,28,29) | Definition date: | 2021-11-22 | Last modified: | 2022-08-22 | Release date: | 2022-05-04 | Identifier: | 3-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-6-phenoxy-phthalazine-1-carboxylic acid |
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![9X2 9X2](https://data.pdbj.org/pdbjplus/data/cc/svg/9X2.svg) | 9X2 | Name: | ~{N}-(2,3-dihydro-1~{H}-inden-2-yl)-3-[[4-[[[(2~{S})-pyrrolidin-2-yl]carbonylamino]methyl]piperidin-1-yl]carbonylamino]pyrazine-2-carboxamide | Formula: | C26 H33 N7 O3 | SMILES: | O=C(NCC1CCN(CC1)C(=O)Nc2nccnc2C(=O)NC3Cc4ccccc4C3)[CH]5CCCN5 | InChi: | InChI=1S/C26H33N7O3/c34-24(21-6-3-9-27-21)30-16-17-7-12-33(13-8-17)26(36)32-23-22(28-10-11-29-23)25(35)31-20-14-18-4-1-2-5-19(18)15-20/h1-2,4-5,10-11,17,20-21,27H,3,6-9,12-16H2,(H,30,34)(H,31,35)(H,29,32,36)/t21-/m0/s1 | Definition date: | 2021-11-22 | Last modified: | 2022-08-22 | Release date: | 2021-12-08 | Identifier: | ~{N}-(2,3-dihydro-1~{H}-inden-2-yl)-3-[[4-[[[(2~{S})-pyrrolidin-2-yl]carbonylamino]methyl]piperidin-1-yl]carbonylamino]pyrazine-2-carboxamide |
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![9XM 9XM](https://data.pdbj.org/pdbjplus/data/cc/svg/9XM.svg) | 9XM | Name: | [(2~{R},3~{S})-2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]piperidin-3-yl] ~{N}-[4-[[3-(2,3-dihydro-1~{H}-inden-2-ylcarbamoyl)pyrazin-2-yl]carbamoyl]piperazin-1-yl]sulfonylcarbamate | Formula: | C36 H38 Br Cl N10 O8 S | SMILES: | Clc1cc2C(=O)N(CC(=O)C[CH]3NCCC[CH]3OC(=O)N[S](=O)(=O)N4CCN(CC4)C(=O)Nc5nccnc5C(=O)NC6Cc7ccccc7C6)C=Nc2cc1Br | InChi: | InChI=1S/C36H38BrClN10O8S/c37-26-18-28-25(17-27(26)38)34(51)47(20-42-28)19-24(49)16-29-30(6-3-7-39-29)56-36(53)45-57(54,55)48-12-10-46(11-13-48)35(52)44-32-31(40-8-9-41-32)33(50)43-23-14-21-4-1-2-5-22(21)15-23/h1-2,4-5,8-9,17-18,20,23,29-30,39H,3,6-7,10-16,19H2,(H,43,50)(H,45,53)(H,41,44,52)/t29-,30+/m1/s1 | Definition date: | 2021-11-22 | Last modified: | 2022-08-22 | Release date: | 2021-12-08 | Identifier: | [(2~{R},3~{S})-2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]piperidin-3-yl] ~{N}-[4-[[3-(2,3-dihydro-1~{H}-inden-2-ylcarbamoyl)pyrazin-2-yl]carbamoyl]piperazin-1-yl]sulfonylcarbamate |
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![9XS 9XS](https://data.pdbj.org/pdbjplus/data/cc/svg/9XS.svg) | 9XS | Name: | (2~{S},3~{R},4~{S})-2-[(2~{S},3~{R})-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]-4-[(3~{S},5~{S})-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-3-methyl-3,4-dihydro-2~{H}-pyrrole-5-carboxylic acid | Formula: | C22 H27 N3 O8 S | SMILES: | C[CH](O)[CH]([CH]1N=C([CH](S[CH]2CN[CH](C2)C(=O)Nc3cccc(c3)C(O)=O)[CH]1C)C(O)=O)C(O)=O | InChi: | InChI=1S/C22H27N3O8S/c1-9-16(15(10(2)26)21(30)31)25-17(22(32)33)18(9)34-13-7-14(23-8-13)19(27)24-12-5-3-4-11(6-12)20(28)29/h3-6,9-10,13-16,18,23,26H,7-8H2,1-2H3,(H,24,27)(H,28,29)(H,30,31)(H,32,33)/t9-,10-,13+,14+,15-,16-,18+/m1/s1 | Definition date: | 2021-11-22 | Last modified: | 2022-08-22 | Release date: | 2021-12-01 | Identifier: | (2~{S},3~{R},4~{S})-2-[(2~{S},3~{R})-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]-4-[(3~{S},5~{S})-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-3-methyl-3,4-dihydro-2~{H}-pyrrole-5-carboxylic acid |
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![9YU 9YU](https://data.pdbj.org/pdbjplus/data/cc/svg/9YU.svg) | 9YU | Name: | 2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol | Formula: | C15 H32 O8 | SMILES: | COCCOCCOCCOCCOCCOCCOCCO | InChi: | InChI=1S/C15H32O8/c1-17-4-5-19-8-9-21-12-13-23-15-14-22-11-10-20-7-6-18-3-2-16/h16H,2-15H2,1H3 | Definition date: | 2021-11-22 | Last modified: | 2022-08-22 | Release date: | 2022-04-06 | Identifier: | 2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
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![9ZG 9ZG](https://data.pdbj.org/pdbjplus/data/cc/svg/9ZG.svg) | 9ZG | Name: | (phenylmethyl) ~{N}-[(2~{S})-1-[[aminomethyl(methyl)amino]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate | Formula: | C20 H26 N4 O3 | SMILES: | CN(CN)N(C)C(=O)[CH](Cc1ccccc1)NC(=O)OCc2ccccc2 | InChi: | InChI=1S/C20H26N4O3/c1-23(15-21)24(2)19(25)18(13-16-9-5-3-6-10-16)22-20(26)27-14-17-11-7-4-8-12-17/h3-12,18H,13-15,21H2,1-2H3,(H,22,26)/t18-/m0/s1 | Definition date: | 2021-11-22 | Last modified: | 2022-08-22 | Release date: | 2022-01-26 | Identifier: | (phenylmethyl) ~{N}-[(2~{S})-1-[[aminomethyl(methyl)amino]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate |
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![A0U A0U](https://data.pdbj.org/pdbjplus/data/cc/svg/A0U.svg) | A0U | Name: | ~{tert}-butyl ~{N}-[iminomethyl-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]amino]carbamate | Formula: | C16 H24 N4 O3 | SMILES: | CN(Cc1ccccc1)C(=O)CN(NC(=O)OC(C)(C)C)C=N | InChi: | InChI=1S/C16H24N4O3/c1-16(2,3)23-15(22)18-20(12-17)11-14(21)19(4)10-13-8-6-5-7-9-13/h5-9,12,17H,10-11H2,1-4H3,(H,18,22)/b17-12+ | Definition date: | 2021-11-23 | Last modified: | 2022-08-22 | Release date: | 2022-01-26 | Identifier: | ~{tert}-butyl ~{N}-[iminomethyl-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]amino]carbamate |
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![FIQ FIQ](https://data.pdbj.org/pdbjplus/data/cc/svg/FIQ.svg) | FIQ | Name: | 6-cyclopropyl-3-methyl-1H-pyrimidine-2,4-dione | Formula: | C8 H10 N2 O2 | SMILES: | CN1C(=O)NC(=CC1=O)C2CC2 | InChi: | InChI=1S/C8H10N2O2/c1-10-7(11)4-6(5-2-3-5)9-8(10)12/h4-5H,2-3H2,1H3,(H,9,12) | Definition date: | 2022-01-24 | Last modified: | 2022-08-22 | Release date: | 2022-03-16 | Identifier: | 6-cyclopropyl-3-methyl-1~{H}-pyrimidine-2,4-dione |
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![A3X A3X](https://data.pdbj.org/pdbjplus/data/cc/svg/A3X.svg) | A3X | Name: | N-(3-metoxy-4-hydroxy-acetophenone)thiosemicarbazone | Formula: | C10 H13 N3 O2 S | SMILES: | COc1cc(ccc1O)C(C)=NNC(N)=S | InChi: | InChI=1S/C10H13N3O2S/c1-6(12-13-10(11)16)7-3-4-8(14)9(5-7)15-2/h3-5,14H,1-2H3,(H3,11,13,16)/b12-6+ | Synonyms: | 1-[(E)-1-(3-methoxy-4-oxidanyl-phenyl)ethylideneamino]thiourea | Definition date: | 2021-11-24 | Last modified: | 2022-08-22 | Release date: | 2022-03-16 | Identifier: | 1-[(~{E})-1-(3-methoxy-4-oxidanyl-phenyl)ethylideneamino]thiourea |
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