 | | 30S | | Name: | 2-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid | | Formula: | C15 H14 N4 O4 S | | SMILES: | O=S(=O)(O)c1ccccc1COc3c2c(nc(nc2N)N)ccc3 | | InChi: | InChI=1S/C15H14N4O4S/c16-14-13-10(18-15(17)19-14)5-3-6-11(13)23-8-9-4-1-2-7-12(9)24(20,21)22/h1-7H,8H2,(H,20,21,22)(H4,16,17,18,19) | | Definition date: | 2014-05-14 | | Last modified: | 2024-09-27 | | Release date: | 2015-05-13 | | Identifier: | 2-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid |
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 | | MYK | | Name: | N~6~-tetradecanoyl-L-lysine | | Formula: | C20 H40 N2 O3 | | SMILES: | O=C(O)C(N)CCCCNC(=O)CCCCCCCCCCCCC | | InChi: | InChI=1S/C20H40N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-16-19(23)22-17-14-13-15-18(21)20(24)25/h18H,2-17,21H2,1H3,(H,22,23)(H,24,25)/t18-/m0/s1 | | Synonyms: | N6-myristoyl lysine | | Definition date: | 2011-10-17 | | Last modified: | 2024-09-27 | | Identifier: | N~6~-tetradecanoyl-L-lysine |
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 | | 30U | | Name: | 4-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid | | Formula: | C15 H14 N4 O4 S | | SMILES: | O=S(=O)(O)c1ccc(cc1)COc3c2c(nc(nc2N)N)ccc3 | | InChi: | InChI=1S/C15H14N4O4S/c16-14-13-11(18-15(17)19-14)2-1-3-12(13)23-8-9-4-6-10(7-5-9)24(20,21)22/h1-7H,8H2,(H,20,21,22)(H4,16,17,18,19) | | Definition date: | 2014-05-15 | | Last modified: | 2024-09-27 | | Release date: | 2015-05-20 | | Identifier: | 4-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid |
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 | | 30V | | Name: | S-[(2-carbamoylphenyl)selanyl]-L-cysteine | | Formula: | C10 H12 N2 O3 S Se | | SMILES: | O=C(O)C(N)CS[Se]c1ccccc1C(=O)N | | InChi: | InChI=1S/C10H12N2O3SSe/c11-7(10(14)15)5-16-17-8-4-2-1-3-6(8)9(12)13/h1-4,7H,5,11H2,(H2,12,13)(H,14,15)/t7-/m0/s1 | | Definition date: | 2014-05-15 | | Last modified: | 2024-09-27 | | Release date: | 2014-07-08 | | Identifier: | S-[(2-carbamoylphenyl)selanyl]-L-cysteine |
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 | | 30W | | Name: | N-(6-formyl-4-oxo-3,4-dihydropteridin-2-yl)acetamide | | Formula: | C9 H7 N5 O3 | | SMILES: | O=C(NC2=Nc1ncc(nc1C(=O)N2)C=O)C | | InChi: | InChI=1S/C9H7N5O3/c1-4(16)11-9-13-7-6(8(17)14-9)12-5(3-15)2-10-7/h2-3H,1H3,(H2,10,11,13,14,16,17) | | Synonyms: | Acetyl 6-formylpterin | | Definition date: | 2014-05-16 | | Last modified: | 2024-09-27 | | Release date: | 2014-07-02 | | Identifier: | N-(6-formyl-4-oxo-3,4-dihydropteridin-2-yl)acetamide |
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 | | MYN | | Name: | (2S)-amino[(4R)-2-amino-1,4,5,6-tetrahydropyrimidin-4-yl]ethanoic acid | | Formula: | C6 H12 N4 O2 | | SMILES: | N[CH]([CH]1CCNC(=N1)N)C(O)=O | | InChi: | InChI=1S/C6H12N4O2/c7-4(5(11)12)3-1-2-9-6(8)10-3/h3-4H,1-2,7H2,(H,11,12)(H3,8,9,10)/t3-,4+/m1/s1 | | Definition date: | 2010-02-12 | | Last modified: | 2024-09-27 | | Identifier: | (2S)-2-azanyl-2-[(4R)-2-azanyl-1,4,5,6-tetrahydropyrimidin-4-yl]ethanoic acid |
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 | | MYR | | Name: | MYRISTIC ACID | | Formula: | C14 H28 O2 | | SMILES: | O=C(O)CCCCCCCCCCCCC | | InChi: | InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16) | | Definition date: | 1999-07-07 | | Last modified: | 2024-09-27 | | Identifier: | tetradecanoic acid |
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 | | 31G | | Name: | 3-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid | | Formula: | C15 H14 N4 O4 S | | SMILES: | O=S(=O)(O)c1cccc(c1)COc3c2c(nc(nc2N)N)ccc3 | | InChi: | InChI=1S/C15H14N4O4S/c16-14-13-11(18-15(17)19-14)5-2-6-12(13)23-8-9-3-1-4-10(7-9)24(20,21)22/h1-7H,8H2,(H,20,21,22)(H4,16,17,18,19) | | Definition date: | 2014-05-16 | | Last modified: | 2024-09-27 | | Release date: | 2015-05-20 | | Identifier: | 3-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid |
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 | | 31J | | Name: | 7-hydroxy-6-methoxy-3-[2-(2-methoxyethoxy)ethyl]-4,8-dimethyl-2H-chromen-2-one | | Formula: | C17 H22 O6 | | SMILES: | O=C2Oc1c(c(O)c(OC)cc1C(=C2CCOCCOC)C)C | | InChi: | InChI=1S/C17H22O6/c1-10-12(5-6-22-8-7-20-3)17(19)23-16-11(2)15(18)14(21-4)9-13(10)16/h9,18H,5-8H2,1-4H3 | | Definition date: | 2014-05-19 | | Last modified: | 2024-09-27 | | Release date: | 2014-09-03 | | Identifier: | 7-hydroxy-6-methoxy-3-[2-(2-methoxyethoxy)ethyl]-4,8-dimethyl-2H-chromen-2-one |
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 | | 31K | | Name: | 2-methoxy-6-methyl-4-(4-methyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl)phenol | | Formula: | C17 H19 N O3 | | SMILES: | Oc3c(cc(c2ccc1c(OCCN1C)c2)cc3OC)C | | InChi: | InChI=1S/C17H19NO3/c1-11-8-13(10-16(20-3)17(11)19)12-4-5-14-15(9-12)21-7-6-18(14)2/h4-5,8-10,19H,6-7H2,1-3H3 | | Definition date: | 2014-05-19 | | Last modified: | 2024-09-27 | | Release date: | 2014-09-03 | | Identifier: | 2-methoxy-6-methyl-4-(4-methyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl)phenol |
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 | | 31L | | Name: | 3-methoxy-5-methyl-4'-(morpholin-4-yl)biphenyl-4-ol | | Formula: | C18 H21 N O3 | | SMILES: | Oc1c(cc(cc1OC)c3ccc(N2CCOCC2)cc3)C | | InChi: | InChI=1S/C18H21NO3/c1-13-11-15(12-17(21-2)18(13)20)14-3-5-16(6-4-14)19-7-9-22-10-8-19/h3-6,11-12,20H,7-10H2,1-2H3 | | Definition date: | 2014-05-19 | | Last modified: | 2024-09-27 | | Release date: | 2014-09-03 | | Identifier: | 3-methoxy-5-methyl-4'-(morpholin-4-yl)biphenyl-4-ol |
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 | | 31Q | | Name: | (4-carboxyphenyl)(L-cysteinato-kappaS~3~)mercury | | Formula: | C10 H11 Hg N O4 S | | SMILES: | O=C(O)C(N)CS[Hg]c1ccc(C(=O)O)cc1 | | InChi: | InChI=1S/C7H5O2.C3H7NO2S.Hg/c8-7(9)6-4-2-1-3-5-6 | | Definition date: | 2014-05-22 | | Last modified: | 2024-09-27 | | Release date: | 2014-07-08 | | Identifier: | (4-carboxyphenyl)(L-cysteinato-kappaS~3~)mercury |
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 | | MZF | | Name: | (3R)-5-bromo-3-hydroxy-1-[(1,2,4-oxadiazol-3-yl)methyl]-1,3-dihydro-2H-indol-2-one | | Formula: | C11 H8 Br N3 O3 | | SMILES: | Brc1cc2C(O)C(=O)N(Cc3ncon3)c2cc1 | | InChi: | InChI=1S/C11H8BrN3O3/c12-6-1-2-8-7(3-6)10(16)11(17)15(8)4-9-13-5-18-14-9/h1-3,5,10,16H,4H2/t10-/m1/s1 | | Definition date: | 2023-08-16 | | Last modified: | 2024-09-27 | | Release date: | 2023-11-08 | | Identifier: | (3R)-5-bromo-3-hydroxy-1-[(1,2,4-oxadiazol-3-yl)methyl]-1,3-dihydro-2H-indol-2-one |
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 | | MZH | | Name: | 1,1'-(oxydimethanediyl)dipyrrolidine-2,5-dione | | Formula: | C10 H12 N2 O5 | | SMILES: | O=C1N(C(=O)CC1)COCN2C(=O)CCC2=O | | InChi: | InChI=1S/C10H12N2O5/c13-7-1-2-8(14)11(7)5-17-6-12-9(15)3-4-10(12)16/h1-6H2 | | Definition date: | 2011-02-24 | | Last modified: | 2024-09-27 | | Identifier: | 1,1'-(oxydimethanediyl)dipyrrolidine-2,5-dione |
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 | | MZN | | Name: | 7-(2-fluoranyl-6-oxidanyl-phenyl)-3-[(3~{R})-1-propanoylpyrrolidin-3-yl]-4~{H}-2,6-naphthyridin-1-one | | Formula: | C21 H20 F N3 O3 | | SMILES: | CCC(=O)N1CC[CH](C1)C2=NC(=O)c3cc(ncc3C2)c4c(O)cccc4F | | InChi: | InChI=1S/C21H20FN3O3/c1-2-19(27)25-7-6-12(11-25)16-8-13-10-23-17(9-14(13)21(28)24-16)20-15(22)4-3-5-18(20)26/h3-5,9-10,12,26H,2,6-8,11H2,1H3/t12-/m1/s1 | | Definition date: | 2019-10-30 | | Last modified: | 2024-09-27 | | Release date: | 2020-04-08 | | Identifier: | 7-(2-fluoranyl-6-oxidanyl-phenyl)-3-[(3~{R})-1-propanoylpyrrolidin-3-yl]-4~{H}-2,6-naphthyridin-1-one |
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 | | MZQ | | Name: | 7-[2,4-bis(fluoranyl)phenyl]-3-[(3~{R})-1-propanoylpyrrolidin-3-yl]-4~{H}-isoquinolin-1-one | | Formula: | C22 H20 F2 N2 O2 | | SMILES: | CCC(=O)N1CC[CH](C1)C2=NC(=O)c3cc(ccc3C2)c4ccc(F)cc4F | | InChi: | InChI=1S/C22H20F2N2O2/c1-2-21(27)26-8-7-15(12-26)20-10-14-4-3-13(9-18(14)22(28)25-20)17-6-5-16(23)11-19(17)24/h3-6,9,11,15H,2,7-8,10,12H2,1H3/t15-/m1/s1 | | Definition date: | 2019-10-30 | | Last modified: | 2024-09-27 | | Release date: | 2020-04-08 | | Identifier: | 7-[2,4-bis(fluoranyl)phenyl]-3-[(3~{R})-1-propanoylpyrrolidin-3-yl]-4~{H}-isoquinolin-1-one |
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 | | 323 | | Name: | 2-[3,6-bis(dimethylamino)xanthen-9-yl]-5-methanoyl-benzoate | | Formula: | C25 H22 N2 O4 | | SMILES: | [O-]C(=O)c4cc(C=O)ccc4C=1c3c(OC=2C=1C=C/C(=[N+](/C)C)C=2)cc(cc3)N(C)C | | InChi: | InChI=1S/C25H22N2O4/c1-26(2)16-6-9-19-22(12-16)31-23-13-17(27(3)4)7-10-20(23)24(19)18-8-5-15(14-28)11-21(18)25(29)30/h5-14H,1-4H3 | | Synonyms: | 5-Carboxy-N,N'-tetramethyl rhodamine | | Definition date: | 2008-06-30 | | Last modified: | 2024-09-27 | | Identifier: | 2-[6-(dimethylamino)-3-(dimethyliminio)-3H-xanthen-9-yl]-5-formylbenzoate |
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 | | N02 | | Name: | (1S,2S)-2-{[N-({[1-(tert-butoxycarbonyl)-4-ethylpiperidin-4-yl]oxy}carbonyl)-L-leucyl]amino}-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid | | Formula: | C26 H46 N4 O10 S | | SMILES: | C(=O)(NC(C(=O)NC(C(O)S(=O)(=O)O)CC1CCNC1=O)CC(C)C)OC2(CCN(CC2)C(=O)OC(C)(C)C)CC | | InChi: | InChI=1S/C26H46N4O10S/c1-7-26(9-12-30(13-10-26)24(35)40-25(4,5)6)39-23(34)29-18(14-16(2)3)21(32)28-19(22(33)41(36,37)38)15-17-8-11-27-20(17)31/h16-19,22,33H,7-15H2,1-6H3,(H,27,31)(H,28,32)(H,29,34)(H,36,37,38)/t17-,18-,19-,22-/m0/s1 | | Synonyms: | bound form | | Definition date: | 2017-07-28 | | Last modified: | 2024-09-27 | | Release date: | 2018-04-04 | | Identifier: | (1S,2S)-2-{[N-({[1-(tert-butoxycarbonyl)-4-ethylpiperidin-4-yl]oxy}carbonyl)-L-leucyl]amino}-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid |
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 | | 32L | | Name: | ethyl (3S,4S)-4-amino-3-hydroxy-6-methylheptanoate | | Formula: | C10 H21 N O3 | | SMILES: | O=C(OCC)CC(O)C(N)CC(C)C | | InChi: | InChI=1S/C10H21NO3/c1-4-14-10(13)6-9(12)8(11)5-7(2)3/h7-9,12H,4-6,11H2,1-3H3/t8-,9-/m0/s1 | | Definition date: | 2014-05-27 | | Last modified: | 2024-09-27 | | Release date: | 2014-06-04 | | Identifier: | ethyl (3S,4S)-4-amino-3-hydroxy-6-methylheptanoate |
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 | | N0A | | Name: | 3-fluoro-L-phenylalanine | | Formula: | C9 H10 F N O2 | | SMILES: | NC(Cc1cccc(c1)F)C(=O)O | | InChi: | InChI=1S/C9H10FNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1 | | Definition date: | 2019-04-26 | | Last modified: | 2024-09-27 | | Release date: | 2020-04-29 | | Identifier: | 3-fluoro-L-phenylalanine |
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 | | 32S | | Name: | (S)-2-AMINO-3-(4H-SELENOLO[3,2-B]-PYRROL-6-YL)-PROPIONIC ACID | | Formula: | C9 H10 N2 O2 Se | | SMILES: | O=C(O)C(N)Cc2c1[se]ccc1nc2 | | InChi: | InChI=1S/C9H10N2O2Se/c10-6(9(12)13)3-5-4-11-7-1-2-14-8(5)7/h1-2,4,6,11H,3,10H2,(H,12,13)/t6-/m0/s1 | | Definition date: | 2003-12-30 | | Last modified: | 2024-09-27 | | Identifier: | 3-(4H-selenopheno[3,2-b]pyrrol-6-yl)-L-alanine |
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 | | 32T | | Name: | (S)-2-AMINO-3-(4H-THIENO[3,2-B]-PYRROL-6-YL)-PROPIONIC ACID | | Formula: | C9 H10 N2 O2 S | | SMILES: | O=C(O)C(N)Cc2c1sccc1nc2 | | InChi: | InChI=1S/C9H10N2O2S/c10-6(9(12)13)3-5-4-11-7-1-2-14-8(5)7/h1-2,4,6,11H,3,10H2,(H,12,13)/t6-/m0/s1 | | Definition date: | 2003-12-30 | | Last modified: | 2024-09-27 | | Identifier: | 3-(4H-thieno[3,2-b]pyrrol-6-yl)-L-alanine |
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 | | N0L | | Name: | 2-chloranyl-N-[3-[1-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonylpiperidin-4-yl]propyl]ethanamide | | Formula: | C22 H31 Cl2 N3 O3 | | SMILES: | ClCC(=O)NCCCC1CCN(CC1)C(=O)C2(CCOCC2)Nc3ccc(Cl)cc3 | | InChi: | InChI=1S/C22H31Cl2N3O3/c23-16-20(28)25-11-1-2-17-7-12-27(13-8-17)21(29)22(9-14-30-15-10-22)26-19-5-3-18(24)4-6-19/h3-6,17,26H,1-2,7-16H2,(H,25,28) | | Definition date: | 2022-08-10 | | Last modified: | 2024-09-27 | | Release date: | 2023-09-20 | | Identifier: | 2-chloranyl-~{N}-[3-[1-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonylpiperidin-4-yl]propyl]ethanamide |
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 | | 339 | | Name: | (S)-2-(3-((R)-1-(4-BROMOPHENYL)ETHYL)UREIDO)-N-((S)-1-((S)-5-GUANIDINO-1-OXO-1-(THIAZOL-2-YL)PENTAN-2-YLAMINO)-3-METHYL-1-OXOBUTAN-2-YL)-5-UREIDOPENTANAMIDE | | Formula: | C29 H45 Br N10 O5 S | | SMILES: | O=C(c1nccs1)C(NC(=O)C(NC(=O)C(NC(=O)NC(c2ccc(Br)cc2)C)CCCNC(=O)N)C(C)C)CCCNC(N)N | | InChi: | InChI=1S/C29H45BrN10O5S/c1-16(2)22(25(43)38-20(6-4-12-35-27(31)32)23(41)26-34-14-15-46-26)40-24(42)21(7-5-13-36-28(33)44)39-29(45)37-17(3)18-8-10-19(30)11-9-18/h8-11,14-17,20-22,27,35H,4-7,12-13,31-32H2,1-3H3,(H,38,43)(H,40,42)(H3,33,36,44)(H2,37,39,45)/t17-,20+,21+,22+/m1/s1 | | Definition date: | 2005-05-25 | | Last modified: | 2024-09-27 | | Identifier: | 2-[N~2~-{[(1R)-1-(4-bromophenyl)ethyl]carbamoyl}-N~5~-carbamoyl-L-ornithyl-L-valyl-N~5~-(diaminomethyl)-L-ornithyl]-1,3-thiazole |
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 | | N10 | | Name: | O-[(HEXYLAMINO)CARBONYL]-L-SERINE | | Formula: | C10 H20 N2 O4 | | SMILES: | O=C(O)C(N)COC(=O)NCCCCCC | | InChi: | InChI=1S/C10H20N2O4/c1-2-3-4-5-6-12-10(15)16-7-8(11)9(13)14/h8H,2-7,11H2,1H3,(H,12,15)(H,13,14)/t8-/m0/s1 | | Definition date: | 2007-05-31 | | Last modified: | 2024-09-27 | | Identifier: | O-(hexylcarbamoyl)-L-serine |
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