 | | V53 | | Name: | 8-azanyl-4-(phosphonomethoxy)quinoline-2-carboxylic acid | | Formula: | C11 H11 N2 O6 P | | SMILES: | Nc1cccc2c(OC[P](O)(O)=O)cc(nc12)C(O)=O | | InChi: | InChI=1S/C11H11N2O6P/c12-7-3-1-2-6-9(19-5-20(16,17)18)4-8(11(14)15)13-10(6)7/h1-4H,5,12H2,(H,14,15)(H2,16,17,18) | | Definition date: | 2023-02-21 | | Last modified: | 2023-11-03 | | Release date: | 2023-07-19 | | Identifier: | 8-azanyl-4-(phosphonomethoxy)quinoline-2-carboxylic acid |
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 | | V5F | | Name: | (2R)-2-(2-azanylphenoxy)propanoic acid | | Formula: | C9 H11 N O3 | | SMILES: | C[CH](Oc1ccccc1N)C(O)=O | | InChi: | InChI=1S/C9H11NO3/c1-6(9(11)12)13-8-5-3-2-4-7(8)10/h2-6H,10H2,1H3,(H,11,12)/t6-/m1/s1 | | Definition date: | 2023-02-21 | | Last modified: | 2023-11-03 | | Release date: | 2023-07-19 | | Identifier: | (2~{R})-2-(2-azanylphenoxy)propanoic acid |
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 | | V5N | | Name: | (2S,3S)-2-azanyl-3-(1H-imidazol-5-yl)-3-oxidanyl-propanoic acid | | Formula: | C6 H9 N3 O3 | | SMILES: | N[CH]([CH](O)c1[nH]cnc1)C(O)=O | | InChi: | InChI=1S/C6H9N3O3/c7-4(6(11)12)5(10)3-1-8-2-9-3/h1-2,4-5,10H,7H2,(H,8,9)(H,11,12)/t4-,5+/m0/s1 | | Definition date: | 2021-04-19 | | Last modified: | 2023-11-03 | | Release date: | 2021-06-02 | | Identifier: | (2~{S},3~{S})-2-azanyl-3-(1~{H}-imidazol-5-yl)-3-oxidanyl-propanoic acid |
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 | | V61 | | Name: | 2,3,5,6-tetrafluoro-4-iodo-L-phenylalanine | | Formula: | C9 H6 F4 I N O2 | | SMILES: | c1(c(c(c(c(c1F)CC(N)C(O)=O)F)F)I)F | | InChi: | InChI=1S/C9H6F4INO2/c10-4-2(1-3(15)9(16)17)5(11)7(13)8(14)6(4)12/h3H,1,15H2,(H,16,17)/t3-/m0/s1 | | Definition date: | 2020-07-06 | | Last modified: | 2023-11-03 | | Release date: | 2021-07-07 | | Identifier: | 2,3,5,6-tetrafluoro-4-iodo-L-phenylalanine |
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 | | IGL | | Name: | ALPHA-AMINO-2-INDANACETIC ACID | | Formula: | C11 H13 N O2 | | SMILES: | O=C(O)C(N)C2Cc1ccccc1C2 | | InChi: | InChI=1S/C11H13NO2/c12-10(11(13)14)9-5-7-3-1-2-4-8(7)6-9/h1-4,9-10H,5-6,12H2,(H,13,14)/t10-/m1/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | (2R)-amino(2,3-dihydro-1H-inden-2-yl)ethanoic acid |
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 | | IIC | | Name: | 4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHORE | | Formula: | C11 H15 N5 O4 | | SMILES: | O=C1C(=NC(N1CC(=O)O)C(N)CO)Cc2cncn2 | | InChi: | InChI=1S/C11H15N5O4/c12-7(4-17)10-15-8(1-6-2-13-5-14-6)11(20)16(10)3-9(18)19/h2,5,7,10,17H,1,3-4,12H2,(H,13,14)(H,18,19)/t7-,10-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | [(2S)-2-[(1R)-1-amino-2-hydroxyethyl]-4-(1H-imidazol-5-ylmethyl)-5-oxo-2,5-dihydro-1H-imidazol-1-yl]acetic acid |
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 | | IKJ | | Name: | (2~{S})-2-azanyl-3-[4-(1-boranyl-1$l^{5}-phospholan-1-yl)phenyl]propanoic acid | | Formula: | C13 H21 B N O2 P | | SMILES: | B[PH]1(CCCC1)c2ccc(C[CH](N)C(O)=O)cc2 | | InChi: | InChI=1S/C13H21BNO2P/c14-18(7-1-2-8-18)11-5-3-10(4-6-11)9-12(15)13(16)17/h3-6,12,18H,1-2,7-9,14-15H2,(H,16,17)/t12-/m0/s1 | | Synonyms: | P3F | | Definition date: | 2022-07-07 | | Last modified: | 2023-11-03 | | Release date: | 2023-07-26 | | Identifier: | (2~{S})-2-azanyl-3-[4-(1-boranyl-1$l^{5}-phospholan-1-yl)phenyl]propanoic acid |
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 | | ILY | | Name: | N~6~-propan-2-yl-L-lysine | | Formula: | C9 H20 N2 O2 | | SMILES: | O=C(O)C(N)CCCCNC(C)C | | InChi: | InChI=1S/C9H20N2O2/c1-7(2)11-6-4-3-5-8(10)9(12)13/h7-8,11H,3-6,10H2,1-2H3,(H,12,13)/t8-/m0/s1 | | Definition date: | 2012-12-12 | | Last modified: | 2023-11-03 | | Release date: | 2013-02-15 | | Identifier: | N~6~-propan-2-yl-L-lysine |
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 | | IO6 | | Name: | 1,1,3-tris(oxidanylidene)-2-pentyl-1,2-benzothiazole-6-sulfonamide | | Formula: | C12 H16 N2 O5 S2 | | SMILES: | CCCCCN1C(=O)c2ccc(cc2[S]1(=O)=O)[S](N)(=O)=O | | InChi: | InChI=1S/C12H16N2O5S2/c1-2-3-4-7-14-12(15)10-6-5-9(20(13,16)17)8-11(10)21(14,18)19/h5-6,8H,2-4,7H2,1H3,(H2,13,16,17) | | Definition date: | 2023-08-02 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | 1,1,3-tris(oxidanylidene)-2-pentyl-1,2-benzothiazole-6-sulfonamide |
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 | | IO8 | | Name: | 2-[2-(aminomethyl)-4-(1H-indol-3-ylmethyl)-5-oxidanylidene-4H-imidazol-1-yl]ethanoic acid | | Formula: | C15 H14 N4 O3 | | SMILES: | NCC1=NC(=Cc2c[nH]c3ccccc23)C(=O)N1CC(O)=O | | InChi: | InChI=1S/C15H14N4O3/c16-6-13-18-12(15(22)19(13)8-14(20)21)5-9-7-17-11-4-2-1-3-10(9)11/h1-5,7,17H,6,8,16H2,(H,20,21)/b12-5- | | Synonyms: | CHROMOPHORE (GLY-TRP-GLY) | | Definition date: | 2022-04-01 | | Last modified: | 2023-11-03 | | Release date: | 2022-05-04 | | Identifier: | 2-[(4~{Z})-2-(aminomethyl)-4-(1~{H}-indol-3-ylmethylidene)-5-oxidanylidene-imidazol-1-yl]ethanoic acid |
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 | | IOY | | Name: | P-IODO-D-PHENYLALANINE | | Formula: | C9 H10 I N O2 | | SMILES: | Ic1ccc(cc1)CC(C(=O)O)N | | InChi: | InChI=1S/C9H10INO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1 | | Synonyms: | 4-IODOPHENYLALANINE | | Definition date: | 2004-09-14 | | Last modified: | 2023-11-03 | | Identifier: | 4-iodo-D-phenylalanine |
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 | | IP8 | | Name: | Isopentenyl phosphate | | Formula: | C5 H11 O4 P | | SMILES: | O=P(OCCC(=C)C)(O)O | | InChi: | InChI=1S/C5H11O4P/c1-5(2)3-4-9-10(6,7)8/h1,3-4H2,2H3,(H2,6,7,8) | | Synonyms: | 3-methylbut-3-en-1-yl dihydrogen phosphate | | Definition date: | 2009-10-21 | | Last modified: | 2023-11-03 | | Identifier: | 3-methylbut-3-en-1-yl dihydrogen phosphate |
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 | | IPI | | Name: | 3-methylbutylphosphonic acid | | Formula: | C5 H13 O3 P | | SMILES: | CC(C)CC[P](O)(O)=O | | InChi: | InChI=1S/C5H13O3P/c1-5(2)3-4-9(6,7)8/h5H,3-4H2,1-2H3,(H2,6,7,8) | | Synonyms: | isoamylphosphonic acid | | Definition date: | 2011-01-21 | | Last modified: | 2023-11-03 | | Identifier: | 3-methylbutylphosphonic acid |
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 | | IQ2 | | Name: | 2-but-2-ynyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-sulfonamide | | Formula: | C11 H10 N2 O5 S2 | | SMILES: | CC#CCN1C(=O)c2ccc(cc2[S]1(=O)=O)[S](N)(=O)=O | | InChi: | InChI=1S/C11H10N2O5S2/c1-2-3-6-13-11(14)9-5-4-8(19(12,15)16)7-10(9)20(13,17)18/h4-5,7H,6H2,1H3,(H2,12,15,16) | | Definition date: | 2023-08-02 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | 2-but-2-ynyl-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-sulfonamide |
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 | | IQE | | Name: | 1,1,3-tris(oxidanylidene)-2-(2-phenylethyl)-1,2-benzothiazole-6-sulfonamide | | Formula: | C15 H14 N2 O5 S2 | | SMILES: | N[S](=O)(=O)c1ccc2C(=O)N(CCc3ccccc3)[S](=O)(=O)c2c1 | | InChi: | InChI=1S/C15H14N2O5S2/c16-23(19,20)12-6-7-13-14(10-12)24(21,22)17(15(13)18)9-8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,16,19,20) | | Definition date: | 2023-08-02 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | 1,1,3-tris(oxidanylidene)-2-(2-phenylethyl)-1,2-benzothiazole-6-sulfonamide |
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 | | ITZ | | Name: | 2-[(1S,2S)-1-amino-2-methylbutyl]-1,3-thiazole-4-carboxylic acid | | Formula: | C9 H14 N2 O2 S | | SMILES: | NC(c1nc(C(=O)O)cs1)C(CC)C | | InChi: | InChI=1S/C9H14N2O2S/c1-3-5(2)7(10)8-11-6(4-14-8)9(12)13/h4-5,7H,3,10H2,1-2H3,(H,12,13)/t5-,7-/m0/s1 | | Definition date: | 2019-12-04 | | Last modified: | 2023-11-03 | | Release date: | 2020-12-02 | | Identifier: | 2-[(1S,2S)-1-amino-2-methylbutyl]-1,3-thiazole-4-carboxylic acid |
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 | | WLU | | Name: | (4R)-5-hydroxy-N-methyl-L-leucine | | Formula: | C7 H15 N O3 | | SMILES: | O=C(O)C(NC)CC(C)CO | | InChi: | InChI=1S/C7H15NO3/c1-5(4-9)3-6(8-2)7(10)11/h5-6,8-9H,3-4H2,1-2H3,(H,10,11)/t5-,6+/m1/s1 | | Definition date: | 2013-06-18 | | Last modified: | 2023-11-03 | | Release date: | 2013-09-18 | | Identifier: | (4R)-5-hydroxy-N-methyl-L-leucine |
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 | | WPA | | Name: | (betaR)-beta-methoxy-L-phenylalanine | | Formula: | C10 H13 N O3 | | SMILES: | O=C(O)C(N)C(OC)c1ccccc1 | | InChi: | InChI=1S/C10H13NO3/c1-14-9(8(11)10(12)13)7-5-3-2-4-6-7/h2-6,8-9H,11H2,1H3,(H,12,13)/t8-,9+/m0/s1 | | Definition date: | 2013-06-18 | | Last modified: | 2023-11-03 | | Release date: | 2013-09-18 | | Identifier: | (betaR)-beta-methoxy-L-phenylalanine |
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 | | WRP | | Name: | (betaR)-beta-hydroxy-1-[(3R)-3-hydroxy-2-methylbutan-2-yl]-L-tryptophan | | Formula: | C16 H22 N2 O4 | | SMILES: | O=C(O)C(N)C(O)c2c1ccccc1n(c2)C(C)(C)C(O)C | | InChi: | InChI=1S/C16H22N2O4/c1-9(19)16(2,3)18-8-11(14(20)13(17)15(21)22)10-6-4-5-7-12(10)18/h4-9,13-14,19-20H,17H2,1-3H3,(H,21,22)/t9-,13+,14-/m1/s1 | | Definition date: | 2013-06-20 | | Last modified: | 2023-11-03 | | Release date: | 2013-09-18 | | Identifier: | (betaR)-beta-hydroxy-1-[(3R)-3-hydroxy-2-methylbutan-2-yl]-L-tryptophan |
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 | | WVL | | Name: | (2S,3R)-2-amino-3,5-dimethylhex-4-enoic acid | | Formula: | C8 H15 N O2 | | SMILES: | O=C(O)C(N)C(C=C(/C)C)C | | InChi: | InChI=1S/C8H15NO2/c1-5(2)4-6(3)7(9)8(10)11/h4,6-7H,9H2,1-3H3,(H,10,11)/t6-,7+/m1/s1 | | Definition date: | 2013-06-18 | | Last modified: | 2023-11-03 | | Release date: | 2013-09-18 | | Identifier: | (2S,3R)-2-amino-3,5-dimethylhex-4-enoic acid |
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 | | WYK | | Name: | (2S,4S)-4-hydroxy-L-arginine | | Formula: | C6 H14 N4 O3 | | SMILES: | N[CH](C[CH](O)CNC(N)=N)C(O)=O | | InChi: | InChI=1S/C6H14N4O3/c7-4(5(12)13)1-3(11)2-10-6(8)9/h3-4,11H,1-2,7H2,(H,12,13)(H4,8,9,10)/t3-,4-/m0/s1 | | Synonyms: | (2S,4S)-2-azanyl-5-carbamimidamido-4-oxidanyl-pentanoic acid | | Definition date: | 2023-05-23 | | Last modified: | 2023-11-03 | | Release date: | 2023-08-09 | | Identifier: | (2~{S},4~{S})-2-azanyl-5-carbamimidamido-4-oxidanyl-pentanoic acid |
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 | | WZJ | | Name: | N-methyl-L-alloisoleucine | | Formula: | C7 H15 N O2 | | SMILES: | N(C)C(C(=O)O)C(C)CC | | InChi: | InChI=1S/C7H15NO2/c1-4-5(2)6(8-3)7(9)10/h5-6,8H,4H2,1-3H3,(H,9,10)/t5-,6+/m1/s1 | | Definition date: | 2020-11-19 | | Last modified: | 2023-11-03 | | Release date: | 2020-12-30 | | Identifier: | N-methyl-L-alloisoleucine |
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 | | X5H | | Name: | (~{E})-6-(2-hydroxy-2-oxoethylamino)hex-4-enoic acid | | Formula: | C8 H13 N O4 | | SMILES: | OC(=O)CCC=CCNCC(O)=O | | InChi: | InChI=1S/C8H13NO4/c10-7(11)4-2-1-3-5-9-6-8(12)13/h1,3,9H,2,4-6H2,(H,10,11)(H,12,13)/b3-1+ | | Definition date: | 2023-05-31 | | Last modified: | 2023-11-03 | | Release date: | 2023-06-07 | | Identifier: | (~{E})-6-(2-hydroxy-2-oxoethylamino)hex-4-enoic acid |
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 | | X5P | | Name: | 4-oxidanylidene-4-[[(2~{S})-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid | | Formula: | C7 H11 N O5 | | SMILES: | C[CH](NC(=O)CCC(O)=O)C(O)=O | | InChi: | InChI=1S/C7H11NO5/c1-4(7(12)13)8-5(9)2-3-6(10)11/h4H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)/t4-/m0/s1 | | Definition date: | 2023-05-31 | | Last modified: | 2023-11-03 | | Release date: | 2023-06-14 | | Identifier: | 4-oxidanylidene-4-[[(2~{S})-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid |
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 | | X60 | | Name: | 2-ethyl-L-norvaline | | Formula: | C7 H15 N O2 | | SMILES: | CCCC(N)(CC)C(=O)O | | InChi: | InChI=1S/C7H15NO2/c1-3-5-7(8,4-2)6(9)10/h3-5,8H2,1-2H3,(H,9,10)/t7-/m0/s1 | | Definition date: | 2023-06-02 | | Last modified: | 2023-11-03 | | Release date: | 2023-08-16 | | Identifier: | 2-ethyl-L-norvaline |
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