 | | U6A | | Name: | N-carboxy-L-threonine | | Formula: | C5 H9 N O5 | | SMILES: | C(NC(C(C)O)C(=O)O)(O)=O | | InChi: | InChI=1S/C5H9NO5/c1-2(7)3(4(8)9)6-5(10)11/h2-3,6-7H,1H3,(H,8,9)(H,10,11)/t2-,3+/m1/s1 | | Definition date: | 2020-04-27 | | Last modified: | 2023-11-03 | | Release date: | 2020-09-23 | | Identifier: | N-carboxy-L-threonine |
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 | | TRN | | Name: | NZ2-TRYPTOPHAN | | Formula: | C10 H11 N3 O2 | | SMILES: | O=C(O)C(N)Cc2c1cccnc1nc2 | | InChi: | InChI=1S/C10H11N3O2/c11-8(10(14)15)4-6-5-13-9-7(6)2-1-3-12-9/h1-3,5,8H,4,11H2,(H,12,13)(H,14,15)/t8-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 3-(1H-pyrrolo[2,3-b]pyridin-3-yl)-L-alanine |
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 | | VEF | | Name: | (3S)-3-azanyl-2,2-bis(oxidanyl)butanoic acid | | Formula: | C4 H9 N O4 | | SMILES: | C[CH](N)C(O)(O)C(O)=O | | InChi: | InChI=1S/C4H9NO4/c1-2(5)4(8,9)3(6)7/h2,8-9H,5H2,1H3,(H,6,7)/t2-/m0/s1 | | Synonyms: | (3S)-3-azanyl-2-oxidanylidene-butanoic acid (precursor) | | Definition date: | 2023-03-03 | | Last modified: | 2023-11-03 | | Release date: | 2023-07-19 | | Identifier: | (3~{S})-3-azanyl-2,2-bis(oxidanyl)butanoic acid |
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 | | TRO | | Name: | 2-HYDROXY-TRYPTOPHAN | | Formula: | C11 H12 N2 O3 | | SMILES: | O=C(O)C(N)Cc2c1ccccc1nc2O | | InChi: | InChI=1S/C11H12N2O3/c12-8(11(15)16)5-7-6-3-1-2-4-9(6)13-10(7)14/h1-4,8,13-14H,5,12H2,(H,15,16)/t8-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 2-hydroxy-L-tryptophan |
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 | | TRP | | Name: | TRYPTOPHAN | | Formula: | C11 H12 N2 O2 | | SMILES: | O=C(O)C(N)Cc2c1ccccc1nc2 | | InChi: | InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | L-tryptophan |
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 | | TRQ | | Name: | 2-AMINO-3-(6,7-DIOXO-6,7-DIHYDRO-1H-INDOL-3-YL)-PROPIONIC ACID | | Formula: | C11 H10 N2 O4 | | SMILES: | O=C(O)C(N)Cc2c1C=CC(=O)C(=O)c1nc2 | | InChi: | InChI=1S/C11H10N2O4/c12-7(11(16)17)3-5-4-13-9-6(5)1-2-8(14)10(9)15/h1-2,4,7,13H,3,12H2,(H,16,17)/t7-/m0/s1 | | Definition date: | 1999-07-08 | | Last modified: | 2023-11-03 | | Identifier: | 3-(6,7-dioxo-6,7-dihydro-1H-indol-3-yl)-L-alanine |
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 | | TRX | | Name: | 6-HYDROXYTRYPTOPHAN | | Formula: | C11 H12 N2 O3 | | SMILES: | O=C(O)C(N)Cc2c1ccc(O)cc1nc2 | | InChi: | InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-4-7(14)1-2-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)/t9-/m0/s1 | | Definition date: | 2001-10-29 | | Last modified: | 2023-11-03 | | Identifier: | 6-hydroxy-L-tryptophan |
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 | | UZ1 | | Name: | cyclopropanamine | | Formula: | C3 H7 N | | SMILES: | NC1CC1 | | InChi: | InChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2 | | Definition date: | 2020-06-08 | | Last modified: | 2023-11-03 | | Release date: | 2020-06-17 | | Identifier: | cyclopropanamine |
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 | | KEO | | Name: | e(R)-beta-lysyl-hydroxylysine | | Formula: | C12 H26 N4 O4 | | SMILES: | NCCC[CH](N)CC(=O)NCC[CH](O)C[CH](N)C(O)=O | | InChi: | InChI=1S/C12H26N4O4/c13-4-1-2-8(14)6-11(18)16-5-3-9(17)7-10(15)12(19)20/h8-10,17H,1-7,13-15H2,(H,16,18)(H,19,20)/t8-,9-,10-/m0/s1 | | Definition date: | 2017-10-05 | | Last modified: | 2023-11-03 | | Release date: | 2017-11-22 | | Identifier: | (2~{S},4~{S})-2-azanyl-6-[[(3~{S})-3,6-bis(azanyl)hexanoyl]amino]-4-oxidanyl-hexanoic acid |
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 | | UZ4 | | Name: | (2R,3S)-3-amino-2-hydroxy-4-[(3S)-2-oxopyrrolidin-3-yl]butanoic acid | | Formula: | C8 H14 N2 O4 | | SMILES: | NC(C(O)C(O)=O)CC1CCNC1=O | | InChi: | InChI=1S/C8H14N2O4/c9-5(6(11)8(13)14)3-4-1-2-10-7(4)12/h4-6,11H,1-3,9H2,(H,10,12)(H,13,14)/t4-,5-,6+/m0/s1 | | Definition date: | 2020-06-08 | | Last modified: | 2023-11-03 | | Release date: | 2020-06-17 | | Identifier: | (2R,3S)-3-amino-2-hydroxy-4-[(3S)-2-oxopyrrolidin-3-yl]butanoic acid |
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 | | VTN | | Name: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}prop-2-enamide | | Formula: | C18 H14 Cl2 N2 O2 | | SMILES: | Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)CCNC(=O)C=C | | InChi: | InChI=1S/C18H14Cl2N2O2/c1-2-18(23)22-6-5-12-3-4-16(20)17(9-12)24-15-8-13(11-21)7-14(19)10-15/h2-4,7-10H,1,5-6H2,(H,22,23) | | Definition date: | 2023-09-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}prop-2-enamide |
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 | | UZ7 | | Name: | phenyl hydrogen carbonate | | Formula: | C7 H6 O3 | | SMILES: | c1cc(ccc1)OC(O)=O | | InChi: | InChI=1S/C7H6O3/c8-7(9)10-6-4-2-1-3-5-6/h1-5H,(H,8,9) | | Definition date: | 2020-06-08 | | Last modified: | 2023-11-03 | | Release date: | 2020-06-17 | | Identifier: | phenyl hydrogen carbonate |
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 | | UZA | | Name: | (2S,6E)-2-amino-2-methylnon-6-enoic acid | | Formula: | C10 H19 N O2 | | SMILES: | NC(C(=O)O)(C)CCCC=CCC | | InChi: | InChI=1S/C10H19NO2/c1-3-4-5-6-7-8-10(2,11)9(12)13/h4-5H,3,6-8,11H2,1-2H3,(H,12,13)/b5-4+/t10-/m0/s1 | | Definition date: | 2020-06-08 | | Last modified: | 2023-11-03 | | Release date: | 2020-07-22 | | Identifier: | (2S,6E)-2-amino-2-methylnon-6-enoic acid |
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 | | VTS | | Name: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide | | Formula: | C19 H16 Cl2 N2 O3 | | SMILES: | Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)OCCN(C)C(=O)C=C | | InChi: | InChI=1S/C19H16Cl2N2O3/c1-3-19(24)23(2)6-7-25-15-4-5-17(21)18(11-15)26-16-9-13(12-22)8-14(20)10-16/h3-5,8-11H,1,6-7H2,2H3 | | Definition date: | 2023-09-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide |
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 | | VTV | | Name: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}-N-methylprop-2-enamide | | Formula: | C19 H16 Cl2 N2 O2 | | SMILES: | Clc1ccc(cc1Oc1cc(C#N)cc(Cl)c1)CCN(C)C(=O)C=C | | InChi: | InChI=1S/C19H16Cl2N2O2/c1-3-19(24)23(2)7-6-13-4-5-17(21)18(10-13)25-16-9-14(12-22)8-15(20)11-16/h3-5,8-11H,1,6-7H2,2H3 | | Definition date: | 2023-09-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | N-{2-[4-chloro-3-(3-chloro-5-cyanophenoxy)phenyl]ethyl}-N-methylprop-2-enamide |
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 | | KF2 | | Name: | [(1~{R})-1-azanyl-3-phenyl-propyl]-[(2~{S})-2-methanoyl-4-methyl-pentyl]phosphinic acid | | Formula: | C16 H26 N O3 P | | SMILES: | CC(C)C[CH](C[P](O)(=O)[CH](N)CCc1ccccc1)C=O | | InChi: | InChI=1S/C16H26NO3P/c1-13(2)10-15(11-18)12-21(19,20)16(17)9-8-14-6-4-3-5-7-14/h3-7,11,13,15-16H,8-10,12,17H2,1-2H3,(H,19,20)/t15-,16+/m0/s1 | | Definition date: | 2019-05-16 | | Last modified: | 2023-11-03 | | Release date: | 2019-12-18 | | Identifier: | [(1~{R})-1-azanyl-3-phenyl-propyl]-[(2~{S})-2-methanoyl-4-methyl-pentyl]phosphinic acid |
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 | | TS9 | | Name: | (2S,3S,4R)-2-amino-3,4-dihydroxy-3-methylpentanoic acid | | Formula: | C6 H13 N O4 | | SMILES: | O=C(O)C(N)C(O)(C)C(O)C | | InChi: | InChI=1S/C6H13NO4/c1-3(8)6(2,11)4(7)5(9)10/h3-4,8,11H,7H2,1-2H3,(H,9,10)/t3-,4-,6-/m1/s1 | | Definition date: | 2008-03-11 | | Last modified: | 2023-11-03 | | Identifier: | (2S,3S,4R)-2-amino-3,4-dihydroxy-3-methylpentanoic acid (non-preferred name) |
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 | | UKD | | Name: | 3-(4-phosphono-1H-1,2,3-triazol-1-yl)-L-alanine | | Formula: | C5 H9 N4 O5 P | | SMILES: | OP(=O)(O)c1nnn(c1)CC(N)C(O)=O | | InChi: | InChI=1S/C5H9N4O5P/c6-3(5(10)11)1-9-2-4(7-8-9)15(12,13)14/h2-3H,1,6H2,(H,10,11)(H2,12,13,14)/t3-/m0/s1 | | Synonyms: | pHis | | Definition date: | 2020-05-20 | | Last modified: | 2023-11-03 | | Release date: | 2021-02-03 | | Identifier: | 3-(4-phosphono-1H-1,2,3-triazol-1-yl)-L-alanine |
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 | | ZPO | | Name: | pyrazolidine-1-carboxylic acid | | Formula: | C4 H8 N2 O2 | | SMILES: | N1CCCN1C(O)=O | | InChi: | InChI=1S/C4H8N2O2/c7-4(8)6-3-1-2-5-6/h5H,1-3H2,(H,7,8) | | Definition date: | 2018-08-22 | | Last modified: | 2023-11-03 | | Release date: | 2019-07-03 | | Identifier: | pyrazolidine-1-carboxylic acid |
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 | | Y57 | | Name: | N~6~-(2-phenylethyl)-N~6~-propan-2-yl-L-lysine | | Formula: | C17 H28 N2 O2 | | SMILES: | C(C)(C)N(CCCCC(N)C(=O)O)CCc1ccccc1 | | InChi: | InChI=1S/C17H28N2O2/c1-14(2)19(12-7-6-10-16(18)17(20)21)13-11-15-8-4-3-5-9-15/h3-5,8-9,14,16H,6-7,10-13,18H2,1-2H3,(H,20,21)/t16-/m0/s1 | | Definition date: | 2021-02-04 | | Last modified: | 2023-11-03 | | Release date: | 2021-12-15 | | Identifier: | N~6~-(2-phenylethyl)-N~6~-propan-2-yl-L-lysine |
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 | | Y58 | | Name: | (2~{R},3~{S},4~{S},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{S},3~{R},4~{S},5~{R},6~{R})-6-(hydroxymethyl)-3,5-bis(oxidanyl)-4-(4-phenylsulfanyl-1,2,3-triazol-1-yl)oxan-2-yl]sulfanyl-oxane-3,4,5-triol | | Formula: | C20 H27 N3 O9 S2 | | SMILES: | OC[CH]1O[CH](S[CH]2O[CH](CO)[CH](O)[CH]([CH]2O)n3cc(Sc4ccccc4)nn3)[CH](O)[CH](O)[CH]1O | | InChi: | InChI=1S/C20H27N3O9S2/c24-7-10-14(26)13(23-6-12(21-22-23)33-9-4-2-1-3-5-9)16(28)19(31-10)34-20-18(30)17(29)15(27)11(8-25)32-20/h1-6,10-11,13-20,24-30H,7-8H2/t10-,11-,13+,14+,15-,16-,17+,18-,19+,20+/m1/s1 | | Definition date: | 2023-06-12 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | (2~{R},3~{S},4~{S},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{S},3~{R},4~{S},5~{R},6~{R})-6-(hydroxymethyl)-3,5-bis(oxidanyl)-4-(4-phenylsulfanyl-1,2,3-triazol-1-yl)oxan-2-yl]sulfanyl-oxane-3,4,5-triol |
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 | | UZN | | Name: | [(2~{S})-2-azanylhexyl]carbamic acid | | Formula: | C7 H16 N2 O2 | | SMILES: | CCCC[CH](N)CNC(O)=O | | InChi: | InChI=1S/C7H16N2O2/c1-2-3-4-6(8)5-9-7(10)11/h6,9H,2-5,8H2,1H3,(H,10,11)/t6-/m0/s1 | | Definition date: | 2019-10-12 | | Last modified: | 2023-11-03 | | Release date: | 2021-02-17 | | Identifier: | [(2~{S})-2-azanylhexyl]carbamic acid |
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 | | KFB | | Name: | 5-Aminovaleric Acid | | Formula: | C5 H11 N O2 | | SMILES: | NCCCCC(O)=O | | InChi: | InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8) | | Synonyms: | 5-aminopentanoic acid | | Definition date: | 2019-05-17 | | Last modified: | 2023-11-03 | | Release date: | 2019-10-23 | | Identifier: | 5-azanylpentanoic acid |
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 | | VU8 | | Name: | N-{2-[5-chloro-2-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide | | Formula: | C19 H16 Cl2 N2 O3 | | SMILES: | Clc1cc(OCCN(C)C(=O)C=C)c(Oc2cc(C#N)cc(Cl)c2)cc1 | | InChi: | InChI=1S/C19H16Cl2N2O3/c1-3-19(24)23(2)6-7-25-18-11-14(20)4-5-17(18)26-16-9-13(12-22)8-15(21)10-16/h3-5,8-11H,1,6-7H2,2H3 | | Definition date: | 2023-09-18 | | Last modified: | 2023-11-03 | | Release date: | 2023-11-08 | | Identifier: | N-{2-[5-chloro-2-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}-N-methylprop-2-enamide |
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 | | VUB | | Name: | 2-[4-[(4-hydroxyphenyl)methyl]-2-(3-methylbutanimidoyl)-5-oxidanyl-imidazol-1-yl]ethanoic acid | | Formula: | C17 H21 N3 O4 | | SMILES: | CC(C)CC(=N)c1nc(Cc2ccc(O)cc2)c(O)n1CC(O)=O | | InChi: | InChI=1S/C17H21N3O4/c1-10(2)7-13(18)16-19-14(17(24)20(16)9-15(22)23)8-11-3-5-12(21)6-4-11/h3-6,10,18,21,24H,7-9H2,1-2H3,(H,22,23)/b18-13- | | Definition date: | 2023-04-05 | | Last modified: | 2023-11-03 | | Release date: | 2023-04-12 | | Identifier: | 2-[4-[(4-hydroxyphenyl)methyl]-2-(3-methylbutanimidoyl)-5-oxidanyl-imidazol-1-yl]ethanoic acid |
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