 | | FP8 | | Name: | (1R,2S)-1-hydroxy-2-[(N-{[(2-methyl-2-azaspiro[3.3]heptan-6-yl)oxy]carbonyl}-L-leucyl)amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid | | Formula: | C28 H40 N4 O9 S | | SMILES: | O=C(Cc1ccccc1)N1CC2(CC(C2)OC(=O)NC(CC(C)C)C(=O)NC(CC2CCNC2=O)C(O)S(=O)(=O)O)C1 | | InChi: | InChI=1S/C28H40N4O9S/c1-17(2)10-21(25(35)30-22(26(36)42(38,39)40)12-19-8-9-29-24(19)34)31-27(37)41-20-13-28(14-20)15-32(16-28)23(33)11-18-6-4-3-5-7-18/h3-7,17,19-22,26,36H,8-16H2,1-2H3,(H,29,34)(H,30,35)(H,31,37)(H,38,39,40)/t19-,21-,22-,26+/m0/s1 | | Definition date: | 2021-12-15 | | Last modified: | 2024-09-27 | | Release date: | 2021-12-22 | | Identifier: | (1R,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-2-{[N-({[2-(phenylacetyl)-2-azaspiro[3.3]heptan-6-yl]oxy}carbonyl)-L-leucyl]amino}propane-1-sulfonic acid |
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 | | ZTA | | Name: | (7M)-7-(furan-2-yl)-2-hydroxynaphthalene-1-carbaldehyde | | Formula: | C15 H10 O3 | | SMILES: | O=Cc1c2cc(ccc2ccc1O)c1ccco1 | | InChi: | InChI=1S/C15H10O3/c16-9-13-12-8-11(15-2-1-7-18-15)4-3-10(12)5-6-14(13)17/h1-9,17H | | Definition date: | 2023-07-03 | | Last modified: | 2024-09-27 | | Release date: | 2023-12-06 | | Identifier: | (7M)-7-(furan-2-yl)-2-hydroxynaphthalene-1-carbaldehyde |
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 | | ZTC | | Name: | (2S)-amino(3,5-dimethoxyphenyl)acetic acid | | Formula: | C10 H13 N O4 | | SMILES: | COc1cc(cc(OC)c1)C(N)C(=O)O | | InChi: | InChI=1S/C10H13NO4/c1-14-7-3-6(9(11)10(12)13)4-8(5-7)15-2/h3-5,9H,11H2,1-2H3,(H,12,13)/t9-/m0/s1 | | Definition date: | 2023-03-30 | | Last modified: | 2024-09-27 | | Release date: | 2023-06-21 | | Identifier: | (2S)-amino(3,5-dimethoxyphenyl)acetic acid |
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 | | FP9 | | Name: | (4R)-4-fluoro-L-proline | | Formula: | C5 H8 F N O2 | | SMILES: | O=C(O)C1NCC(F)C1 | | InChi: | InChI=1S/C5H8FNO2/c6-3-1-4(5(8)9)7-2-3/h3-4,7H,1-2H2,(H,8,9)/t3-,4+/m1/s1 | | Definition date: | 2009-08-18 | | Last modified: | 2024-09-27 | | Identifier: | (4R)-4-fluoro-L-proline |
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 | | FPA | | Name: | bromo(difluoro)acetic acid | | Formula: | C2 H Br F2 O2 | | SMILES: | C(F)(F)(C(=O)O)Br | | InChi: | InChI=1S/C2HBrF2O2/c3-2(4,5)1(6)7/h(H,6,7) | | Definition date: | 1999-07-08 | | Last modified: | 2024-09-27 | | Identifier: | bromo(difluoro)acetic acid |
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 | | ZTG | | Name: | (betaR)-3-chloro-beta-{[tri(propan-2-yl)silyl]oxy}-D-tyrosine | | Formula: | C18 H30 Cl N O4 Si | | SMILES: | Oc1ccc(cc1Cl)C(O[Si](C(C)C)(C(C)C)C(C)C)C(N)C(=O)O | | InChi: | InChI=1S/C18H30ClNO4Si/c1-10(2)25(11(3)4,12(5)6)24-17(16(20)18(22)23)13-7-8-15(21)14(19)9-13/h7-12,16-17,21H,20H2,1-6H3,(H,22,23)/t16-,17-/m1/s1 | | Definition date: | 2023-03-30 | | Last modified: | 2024-09-27 | | Release date: | 2023-06-21 | | Identifier: | (betaR)-3-chloro-beta-{[tri(propan-2-yl)silyl]oxy}-D-tyrosine |
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 | | ZTK | | Name: | (2S)-2-amino-3-cyanopropanoic acid | | Formula: | C4 H6 N2 O2 | | SMILES: | N#CCC(N)C(=O)O | | InChi: | InChI=1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)/t3-/m0/s1 | | Definition date: | 2023-03-30 | | Last modified: | 2024-09-27 | | Release date: | 2023-06-21 | | Identifier: | (2S)-2-amino-3-cyanopropanoic acid |
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 | | YDL | | Name: | N-(methoxycarbonyl)-3-methyl-L-valyl-(4R)-N-{(1Z,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-4-(trifluoromethyl)-L-prolinamide | | Formula: | C21 H32 F3 N5 O5 | | SMILES: | FC(F)(F)C1CC(C(=O)NC(C=N)CC2CCNC2=O)N(C1)C(=O)C(NC(=O)OC)C(C)(C)C | | InChi: | InChI=1S/C21H32F3N5O5/c1-20(2,3)15(28-19(33)34-4)18(32)29-10-12(21(22,23)24)8-14(29)17(31)27-13(9-25)7-11-5-6-26-16(11)30/h9,11-15,25H,5-8,10H2,1-4H3,(H,26,30)(H,27,31)(H,28,33)/t11-,12+,13-,14-,15+/m0/s1 | | Synonyms: | Ibuzatrelvir, bound form | | Definition date: | 2023-12-01 | | Last modified: | 2024-09-27 | | Release date: | 2024-05-15 | | Identifier: | N-(methoxycarbonyl)-3-methyl-L-valyl-(4R)-N-{(1Z,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-4-(trifluoromethyl)-L-prolinamide |
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 | | YDM | | Name: | 1-[6-(dimethylamino)naphthalen-2-yl]propan-1-one | | Formula: | C15 H17 N O | | SMILES: | CCC(=O)c1ccc2cc(ccc2c1)N(C)C | | InChi: | InChI=1S/C15H17NO/c1-4-15(17)13-6-5-12-10-14(16(2)3)8-7-11(12)9-13/h5-10H,4H2,1-3H3 | | Synonyms: | acrylodan, bound form | | Definition date: | 2023-01-26 | | Last modified: | 2024-09-27 | | Release date: | 2023-08-30 | | Identifier: | 1-[6-(dimethylamino)naphthalen-2-yl]propan-1-one |
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 | | ZTO | | Name: | N-(3-{[(3R)-5-fluoro-2-oxo-2,3-dihydro-1H-indol-3-yl]methyl}phenyl)-4-methoxybenzamide | | Formula: | C23 H19 F N2 O3 | | SMILES: | COc1ccc(cc1)C(=O)Nc1cccc(c1)CC1c2cc(F)ccc2NC1=O | | InChi: | InChI=1S/C23H19FN2O3/c1-29-18-8-5-15(6-9-18)22(27)25-17-4-2-3-14(11-17)12-20-19-13-16(24)7-10-21(19)26-23(20)28/h2-11,13,20H,12H2,1H3,(H,25,27)(H,26,28)/t20-/m1/s1 | | Definition date: | 2023-03-31 | | Last modified: | 2024-09-27 | | Release date: | 2024-03-27 | | Identifier: | N-(3-{[(3R)-5-fluoro-2-oxo-2,3-dihydro-1H-indol-3-yl]methyl}phenyl)-4-methoxybenzamide |
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 | | FPJ | | Name: | 5'-O-[(R)-hydroxy(propanoylamino)phosphoryl]adenosine | | Formula: | C13 H19 N6 O7 P | | SMILES: | c2n(c1c(c(ncn1)N)n2)C3C(C(O)C(COP(NC(=O)CC)(O)=O)O3)O | | InChi: | InChI=1S/C13H19N6O7P/c1-2-7(20)18-27(23,24)25-3-6-9(21)10(22)13(26-6)19-5-17-8-11(14)15-4-16-12(8)19/h4-6,9-10,13,21-22H,2-3H2,1H3,(H2,14,15,16)(H2,18,20,23,24)/t6-,9-,10-,13-/m1/s1 | | Definition date: | 2018-04-11 | | Last modified: | 2024-09-27 | | Release date: | 2018-08-08 | | Identifier: | 5'-O-[(R)-hydroxy(propanoylamino)phosphoryl]adenosine |
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 | | YQV | | Name: | methyl {(1S,2R)-2-[(1S)-2-(azetidin-1-yl)-1-(3-fluorophenyl)-1-{1-[(3-methoxy-1-{4-[(1S,4S)-5-propanoyl-2,5-diazabicyclo[2.2.1]heptane-2-sulfonyl]phenyl}azetidin-3-yl)methyl]piperidin-4-yl}ethyl]cyclopentyl}carbamate | | Formula: | C42 H59 F N6 O6 S | | SMILES: | O=S(=O)(c1ccc(cc1)N1CC(CN2CCC(CC2)C(CN2CCC2)(c2cccc(F)c2)C2CCCC2NC(=O)OC)(OC)C1)N1CC2CC1CN2C(=O)CC | | InChi: | InChI=1S/C42H59FN6O6S/c1-4-39(50)48-24-35-23-34(48)25-49(35)56(52,53)36-14-12-33(13-15-36)47-27-41(28-47,55-3)26-46-20-16-30(17-21-46)42(29-45-18-7-19-45,31-8-5-9-32(43)22-31)37-10-6-11-38(37)44-40(51)54-2/h5,8-9,12-15,22,30,34-35,37-38H,4,6-7,10-11,16-21,23-29H2,1-3H3,(H,44,51)/t34-,35-,37-,38-,42-/m0/s1 | | Definition date: | 2021-03-24 | | Last modified: | 2024-09-27 | | Release date: | 2021-08-11 | | Identifier: | methyl {(1S,2R)-2-[(1S)-2-(azetidin-1-yl)-1-(3-fluorophenyl)-1-{1-[(3-methoxy-1-{4-[(1S,4S)-5-propanoyl-2,5-diazabicyclo[2.2.1]heptane-2-sulfonyl]phenyl}azetidin-3-yl)methyl]piperidin-4-yl}ethyl]cyclopentyl}carbamate |
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 | | FPK | | Name: | 1-formyl-L-proline | | Formula: | C6 H9 N O3 | | SMILES: | O=CN1C(C(=O)O)CCC1 | | InChi: | InChI=1S/C6H9NO3/c8-4-7-3-1-2-5(7)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m0/s1 | | Definition date: | 2012-10-08 | | Last modified: | 2024-09-27 | | Release date: | 2013-05-29 | | Identifier: | 1-formyl-L-proline |
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 | | ZBR | | Name: | 1,3,5-tris(bromomethyl)benzene | | Formula: | C9 H9 Br3 | | SMILES: | BrCc1cc(cc(c1)CBr)CBr | | InChi: | InChI=1S/C9H9Br3/c10-4-7-1-8(5-11)3-9(2-7)6-12/h1-3H,4-6H2 | | Definition date: | 2011-02-16 | | Last modified: | 2024-09-27 | | Identifier: | 1,3,5-tris(bromomethyl)benzene |
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 | | YDQ | | Name: | 2-bromo-1-[6-(dimethylamino)naphthalen-2-yl]ethan-1-one | | Formula: | C14 H14 Br N O | | SMILES: | BrCC(=O)c1ccc2cc(ccc2c1)N(C)C | | InChi: | InChI=1S/C14H14BrNO/c1-16(2)13-6-5-10-7-12(14(17)9-15)4-3-11(10)8-13/h3-8H,9H2,1-2H3 | | Synonyms: | BADAN | | Definition date: | 2023-01-26 | | Last modified: | 2024-09-27 | | Release date: | 2023-08-30 | | Identifier: | 2-bromo-1-[6-(dimethylamino)naphthalen-2-yl]ethan-1-one |
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 | | NTA | | Name: | NITRILOTRIACETIC ACID | | Formula: | C6 H9 N O6 | | SMILES: | O=C(O)CN(CC(=O)O)CC(=O)O | | InChi: | InChI=1S/C6H9NO6/c8-4(9)1-7(2-5(10)11)3-6(12)13/h1-3H2,(H,8,9)(H,10,11)(H,12,13) | | Definition date: | 1999-09-02 | | Last modified: | 2024-09-27 | | Identifier: | 2,2',2''-nitrilotriacetic acid |
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 | | ZBZ | | Name: | S-(phenylcarbonyl)-L-cysteine | | Formula: | C10 H11 N O3 S | | SMILES: | O=C(O)C(N)CSC(=O)c1ccccc1 | | InChi: | InChI=1S/C10H11NO3S/c11-8(9(12)13)6-15-10(14)7-4-2-1-3-5-7/h1-5,8H,6,11H2,(H,12,13)/t8-/m0/s1 | | Definition date: | 2010-02-09 | | Last modified: | 2024-09-27 | | Identifier: | S-benzoyl-L-cysteine |
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 | | FPR | | Name: | (3S)-3-amino-4-oxo-7-phenylheptanoic acid | | Formula: | C13 H17 N O3 | | SMILES: | O=C(O)CC(N)C(=O)CCCc1ccccc1 | | InChi: | InChI=1S/C13H17NO3/c14-11(9-13(16)17)12(15)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,14H2,(H,16,17)/t11-/m0/s1 | | Definition date: | 2003-11-19 | | Last modified: | 2024-09-27 | | Identifier: | (3S)-3-amino-4-oxo-7-phenylheptanoic acid |
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 | | ZU0 | | Name: | O-tert-butyl-L-threonine | | Formula: | C8 H17 N O3 | | SMILES: | O=C(O)C(N)C(OC(C)(C)C)C | | InChi: | InChI=1S/C8H17NO3/c1-5(6(9)7(10)11)12-8(2,3)4/h5-6H,9H2,1-4H3,(H,10,11)/t5-,6+/m1/s1 | | Definition date: | 2008-12-10 | | Last modified: | 2024-09-27 | | Identifier: | O-tert-butyl-L-threonine |
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 | | ZU3 | | Name: | N-[(benzyloxy)carbonyl]-3-[(2,2-dimethylpropanoyl)amino]-L-alanyl-N-[(1R)-4-oxo-1-{[(3S)-2-oxopyrrolidin-3-yl]methyl}pentyl]-L-leucinamide | | Formula: | C32 H49 N5 O7 | | SMILES: | O=C(OCc1ccccc1)NC(C(=O)NC(C(=O)NC(CC2C(=O)NCC2)CCC(=O)C)CC(C)C)CNC(=O)C(C)(C)C | | InChi: | InChI=1S/C32H49N5O7/c1-20(2)16-25(28(40)35-24(13-12-21(3)38)17-23-14-15-33-27(23)39)36-29(41)26(18-34-30(42)32(4,5)6)37-31(43)44-19-22-10-8-7-9-11-22/h7-11,20,23-26H,12-19H2,1-6H3,(H,33,39)(H,34,42)(H,35,40)(H,36,41)(H,37,43)/t23-,24+,25-,26-/m0/s1 | | Synonyms: | TG-0204998 | | Definition date: | 2008-10-30 | | Last modified: | 2024-09-27 | | Identifier: | N-[(benzyloxy)carbonyl]-3-[(2,2-dimethylpropanoyl)amino]-L-alanyl-N-{(2R)-5-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]hexan-2-yl}-L-leucinamide |
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 | | ZU5 | | Name: | N-[(benzyloxy)carbonyl]-O-tert-butyl-L-threonyl-N-[(1R)-4-cyclopropyl-4-oxo-1-{[(3S)-2-oxopyrrolidin-3-yl]methyl}butyl]-L-leucinamide | | Formula: | C34 H52 N4 O7 | | SMILES: | O=C(OCc1ccccc1)NC(C(=O)NC(C(=O)NC(CC2C(=O)NCC2)CCC(=O)C3CC3)CC(C)C)C(OC(C)(C)C)C | | InChi: | InChI=1S/C34H52N4O7/c1-21(2)18-27(31(41)36-26(14-15-28(39)24-12-13-24)19-25-16-17-35-30(25)40)37-32(42)29(22(3)45-34(4,5)6)38-33(43)44-20-23-10-8-7-9-11-23/h7-11,21-22,24-27,29H,12-20H2,1-6H3,(H,35,40)(H,36,41)(H,37,42)(H,38,43)/t22-,25+,26-,27+,29+/m1/s1 | | Synonyms: | TG-0205486 | | Definition date: | 2008-12-10 | | Last modified: | 2024-09-27 | | Identifier: | N-[(benzyloxy)carbonyl]-O-tert-butyl-L-threonyl-N-{(2R)-5-cyclopropyl-5-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]pentan-2-yl}-L-leucinamide |
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 | | ZCI | | Name: | 2-bromo-1H-imidazole | | Formula: | C3 H3 Br N2 | | SMILES: | Brc1ncc[NH]1 | | InChi: | InChI=1S/C3H3BrN2/c4-3-5-1-2-6-3/h1-2H,(H,5,6) | | Definition date: | 2023-06-23 | | Last modified: | 2024-09-27 | | Release date: | 2023-07-12 | | Identifier: | 2-bromo-1H-imidazole |
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 | | ZCL | | Name: | 3,4-dichloro-L-phenylalanine | | Formula: | C9 H9 Cl2 N O2 | | SMILES: | Clc1ccc(cc1Cl)CC(C(=O)O)N | | InChi: | InChI=1S/C9H9Cl2NO2/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-3,8H,4,12H2,(H,13,14)/t8-/m0/s1 | | Definition date: | 2010-12-29 | | Last modified: | 2024-09-27 | | Identifier: | 3,4-dichloro-L-phenylalanine |
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 | | NTJ | | Name: | R-ETHYL N,N-DIMETHYLPHOSPHONAMIDATE | | Formula: | C4 H12 N O2 P | | SMILES: | O=P(OCC)N(C)C | | InChi: | InChI=1S/C4H12NO2P/c1-4-7-8(6)5(2)3/h8H,4H2,1-3H3 | | Definition date: | 2005-09-07 | | Last modified: | 2024-09-27 | | Identifier: | ethyl (S)-N,N-dimethylphosphonamidoate |
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 | | YE3 | | Name: | (8M)-8-(2-{[2-(fluorosulfonyl)ethyl]amino}phenyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid | | Formula: | C18 H15 F N2 O5 S | | SMILES: | FS(=O)(=O)CCNc1ccccc1c1cccc2c1NC=C(C2=O)C(=O)O | | InChi: | InChI=1S/C18H15FN2O5S/c19-27(25,26)9-8-20-15-7-2-1-4-11(15)12-5-3-6-13-16(12)21-10-14(17(13)22)18(23)24/h1-7,10,20H,8-9H2,(H,21,22)(H,23,24) | | Definition date: | 2023-12-01 | | Last modified: | 2024-09-27 | | Release date: | 2024-09-25 | | Identifier: | (8M)-8-(2-{[2-(fluorosulfonyl)ethyl]amino}phenyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
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