![4HH 4HH](https://data.pdbj.org/pdbjplus/data/cc/svg/4HH.svg) | 4HH | Name: | 4'-phosphopanthetheine-serine | Formula: | C14 H28 N3 O9 P S | SMILES: | O=C(O)C(N)COP(O)(=O)OCC(C)(C(C(=O)NCCC(=O)NCCS)O)C | InChi: | InChI=1S/C14H28N3O9PS/c1-14(2,8-26-27(23,24)25-7-9(15)13(21)22)11(19)12(20)17-4-3-10(18)16-5-6-28/h9,11,19,28H,3-8,15H2,1-2H3,(H,16,18)(H,17,20)(H,21,22)(H,23,24)/t9-,11-/m0/s1 | Synonyms: | O-[(S)-hydroxy{[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl]oxy}phosphoryl]-L-serine | Definition date: | 2015-09-08 | Last modified: | 2023-11-03 | Release date: | 2015-09-23 | Identifier: | O-[(S)-hydroxy{[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl]oxy}phosphoryl]-L-serine |
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![4HL 4HL](https://data.pdbj.org/pdbjplus/data/cc/svg/4HL.svg) | 4HL | Name: | (6E)-4-[(2S)-2-amino-2-carboxyethyl]-6-[2-(4-hydroxybenzyl)hydraziniumylidene]-3-oxocyclohexa-1,4-dien-1-olate | Formula: | C16 H17 N3 O5 | SMILES: | O=C1C=C([O-])/C(C=C1CC(C(=O)O)N)=[NH+]/NCc2ccc(O)cc2 | InChi: | InChI=1S/C16H17N3O5/c17-12(16(23)24)5-10-6-13(15(22)7-14(10)21)19-18-8-9-1-3-11(20)4-2-9/h1-4,6-7,12,18,20,22H,5,8,17H2,(H,23,24)/b19-13+/t12-/m0/s1 | Definition date: | 2006-11-30 | Last modified: | 2023-11-03 | Identifier: | (6E)-4-[(2S)-2-amino-2-carboxyethyl]-6-[2-(4-hydroxybenzyl)hydraziniumylidene]-3-oxocyclohexa-1,4-dien-1-olate |
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![4HT 4HT](https://data.pdbj.org/pdbjplus/data/cc/svg/4HT.svg) | 4HT | Name: | 4-HYDROXYTRYPTOPHAN | Formula: | C11 H12 N2 O3 | SMILES: | O=C(O)C(N)Cc2c1c(cccc1O)nc2 | InChi: | InChI=1S/C11H12N2O3/c12-7(11(15)16)4-6-5-13-8-2-1-3-9(14)10(6)8/h1-3,5,7,13-14H,4,12H2,(H,15,16)/t7-/m0/s1 | Definition date: | 2004-01-20 | Last modified: | 2023-11-03 | Identifier: | 4-hydroxy-L-tryptophan |
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![4II 4II](https://data.pdbj.org/pdbjplus/data/cc/svg/4II.svg) | 4II | Name: | (2~{S})-2-azanyl-3-(4-azidophenyl)propanoic acid | Formula: | C9 H10 N4 O2 | SMILES: | N[CH](Cc1ccc(cc1)N=[N+]=[N-])C(O)=O | InChi: | InChI=1S/C9H10N4O2/c10-8(9(14)15)5-6-1-3-7(4-2-6)12-13-11/h1-4,8H,5,10H2,(H,14,15)/t8-/m0/s1 | Definition date: | 2018-08-19 | Last modified: | 2023-11-03 | Release date: | 2018-12-05 | Identifier: | (2~{S})-2-azanyl-3-(4-azidophenyl)propanoic acid |
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![4IN 4IN](https://data.pdbj.org/pdbjplus/data/cc/svg/4IN.svg) | 4IN | Name: | 4-AMINO-L-TRYPTOPHAN | Formula: | C11 H13 N3 O2 | SMILES: | O=C(O)C(N)Cc2c1c(cccc1nc2)N | InChi: | InChI=1S/C11H13N3O2/c12-7-2-1-3-9-10(7)6(5-14-9)4-8(13)11(15)16/h1-3,5,8,14H,4,12-13H2,(H,15,16)/t8-/m0/s1 | Synonyms: | 2-AMINO-3-(4-AMINO-1H-INDOL-3-YL)PROPANOIC ACID | Definition date: | 2003-04-15 | Last modified: | 2023-11-03 | Identifier: | 4-amino-L-tryptophan |
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![4KY 4KY](https://data.pdbj.org/pdbjplus/data/cc/svg/4KY.svg) | 4KY | Name: | (4R)-1-acetyl-4-(oct-7-en-1-yloxy)-L-proline | Formula: | C15 H25 N O4 | SMILES: | C(=C)CCCCCCOC1CC(C(=O)O)N(C1)C(C)=O | InChi: | InChI=1S/C15H25NO4/c1-3-4-5-6-7-8-9-20-13-10-14(15(18)19)16(11-13)12(2)17/h3,13-14H,1,4-11H2,2H3,(H,18,19)/t13-,14+/m1/s1 | Definition date: | 2015-04-01 | Last modified: | 2023-11-03 | Release date: | 2015-07-29 | Identifier: | (4R)-1-acetyl-4-(oct-7-en-1-yloxy)-L-proline |
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![4L0 4L0](https://data.pdbj.org/pdbjplus/data/cc/svg/4L0.svg) | 4L0 | Name: | (4R)-1-acetyl-4-(hexyloxy)-L-proline | Formula: | C13 H23 N O4 | SMILES: | N1(CC(CC1C(=O)O)OCCCCCC)C(C)=O | InChi: | InChI=1S/C13H23NO4/c1-3-4-5-6-7-18-11-8-12(13(16)17)14(9-11)10(2)15/h11-12H,3-9H2,1-2H3,(H,16,17)/t11-,12+/m1/s1 | Synonyms: | (4R)-1-acetyl-4-(hex-5-en-1-yloxy)-L-proline (bound form) | Definition date: | 2015-04-02 | Last modified: | 2023-11-03 | Release date: | 2015-07-29 | Identifier: | (4R)-1-acetyl-4-(hexyloxy)-L-proline |
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![4LZ 4LZ](https://data.pdbj.org/pdbjplus/data/cc/svg/4LZ.svg) | 4LZ | Name: | O-[2-(triaza-1,2-dien-2-ium-1-yl)ethyl]-L-tyrosine | Formula: | C11 H15 N4 O3 | SMILES: | C(C(N)Cc1ccc(OCCN=[N+]=N)cc1)(=O)O | InChi: | InChI=1S/C11H14N4O3/c12-10(11(16)17)7-8-1-3-9(4-2-8)18-6-5-14-15-13/h1-4,10,13H,5-7,12H2/p+1/t10-/m0/s1 | Definition date: | 2015-04-14 | Last modified: | 2023-11-03 | Release date: | 2015-05-06 | Identifier: | O-[2-(triaza-1,2-dien-2-ium-1-yl)ethyl]-L-tyrosine |
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![4NT 4NT](https://data.pdbj.org/pdbjplus/data/cc/svg/4NT.svg) | 4NT | Name: | [(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(3-chloro-4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid | Formula: | C15 H16 Cl N3 O5 | SMILES: | NC(C(O)C)C1=N/C(C(N1CC(O)=O)=O)=Cc2cc(Cl)c(cc2)O | InChi: | InChI=1S/C15H16ClN3O5/c1-7(20)13(17)14-18-10(15(24)19(14)6-12(22)23)5-8-2-3-11(21)9(16)4-8/h2-5,7,13,20-21H,6,17H2,1H3,(H,22,23)/b10-5-/t7-,13+/m1/s1 | Synonyms: | PEPTIDE DERIVED CHROMOPHORE | Definition date: | 2015-04-21 | Last modified: | 2023-11-03 | Release date: | 2015-06-10 | Identifier: | [(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(3-chloro-4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid |
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![4NU 4NU](https://data.pdbj.org/pdbjplus/data/cc/svg/4NU.svg) | 4NU | Name: | {(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid | Formula: | C15 H15 Cl2 N3 O5 | SMILES: | NC(C(O)C)C1=N/C(C(N1CC(O)=O)=O)=CC2C=C(Cl)C(C(=C2)Cl)=O | InChi: | InChI=1S/C15H15Cl2N3O5/c1-6(21)12(18)14-19-10(15(25)20(14)5-11(22)23)4-7-2-8(16)13(24)9(17)3-7/h2-4,6-7,12,21H,5,18H2,1H3,(H,22,23)/b10-4-/t6-,12+/m1/s1 | Synonyms: | PEPTIDE DERIVED CHROMOPHORE | Definition date: | 2015-04-21 | Last modified: | 2023-11-03 | Release date: | 2015-06-10 | Identifier: | {(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid |
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![4OG 4OG](https://data.pdbj.org/pdbjplus/data/cc/svg/4OG.svg) | 4OG | Name: | 3-(1-benzothiophen-3-yl)-L-alanine | Formula: | C11 H11 N O2 S | SMILES: | c12scc(c1cccc2)CC(N)C(O)=O | InChi: | InChI=1S/C11H11NO2S/c12-9(11(13)14)5-7-6-15-10-4-2-1-3-8(7)10/h1-4,6,9H,5,12H2,(H,13,14)/t9-/m0/s1 | Definition date: | 2015-04-28 | Last modified: | 2023-11-03 | Release date: | 2016-03-02 | Identifier: | 3-(1-benzothiophen-3-yl)-L-alanine |
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![4OU 4OU](https://data.pdbj.org/pdbjplus/data/cc/svg/4OU.svg) | 4OU | Name: | 4-(acryloylamino)-L-phenylalanine | Formula: | C12 H14 N2 O3 | SMILES: | c1(ccc(NC([C@H]=C)=O)cc1)CC(C(=O)O)N | InChi: | InChI=1S/C12H14N2O3/c1-2-11(15)14-9-5-3-8(4-6-9)7-10(13)12(16)17/h2-6,10H,1,7,13H2,(H,14,15)(H,16,17)/t10-/m0/s1 | Definition date: | 2015-04-29 | Last modified: | 2023-11-03 | Release date: | 2015-05-20 | Identifier: | 4-(acryloylamino)-L-phenylalanine |
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![4PQ 4PQ](https://data.pdbj.org/pdbjplus/data/cc/svg/4PQ.svg) | 4PQ | Name: | 5-hydroxy-L-tryptophan | Formula: | C11 H12 N2 O3 | SMILES: | NC(C(=O)O)Cc1cnc2ccc(cc12)O | InChi: | InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-2-1-7(14)4-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)/t9-/m0/s1 | Synonyms: | Oxitriptan | Definition date: | 2015-05-01 | Last modified: | 2023-11-03 | Release date: | 2017-01-11 | Identifier: | 5-hydroxy-L-tryptophan |
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![4QK 4QK](https://data.pdbj.org/pdbjplus/data/cc/svg/4QK.svg) | 4QK | Name: | 6-[4-(2-aminoethyl)-1H-1,2,3-triazol-1-yl]-L-norleucine | Formula: | C10 H19 N5 O2 | SMILES: | NC(CCCCn1cc(CCN)nn1)C(O)=O | InChi: | InChI=1S/C10H19N5O2/c11-5-4-8-7-15(14-13-8)6-2-1-3-9(12)10(16)17/h7,9H,1-6,11-12H2,(H,16,17)/t9-/m0/s1 | Definition date: | 2016-07-19 | Last modified: | 2023-11-03 | Release date: | 2016-09-21 | Identifier: | 6-[4-(2-aminoethyl)-1H-1,2,3-triazol-1-yl]-L-norleucine |
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![IEY IEY](https://data.pdbj.org/pdbjplus/data/cc/svg/IEY.svg) | IEY | Name: | {5-hydroxy-4-(4-hydroxybenzyl)-2-[(E)-2-(1H-imidazol-4-yl)ethenyl]-1H-imidazol-1-yl}acetic acid | Formula: | C17 H16 N4 O4 | SMILES: | O=C(O)Cn2c(O)c(nc2C=Cc1ncnc1)Cc3ccc(O)cc3 | InChi: | InChI=1S/C17H16N4O4/c22-13-4-1-11(2-5-13)7-14-17(25)21(9-16(23)24)15(20-14)6-3-12-8-18-10-19-12/h1-6,8,10,14,22H,7,9H2,(H,18,19)(H,23,24)/b6-3+/t14-/m0/s1 | Synonyms: | CHROMOPHORE (HIS-TYR-GLY) | Definition date: | 2005-06-01 | Last modified: | 2023-11-03 | Identifier: | {5-hydroxy-4-(4-hydroxybenzyl)-2-[(E)-2-(1H-imidazol-4-yl)ethenyl]-1H-imidazol-1-yl}acetic acid |
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![IGL IGL](https://data.pdbj.org/pdbjplus/data/cc/svg/IGL.svg) | 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 IIC](https://data.pdbj.org/pdbjplus/data/cc/svg/IIC.svg) | 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 IKJ](https://data.pdbj.org/pdbjplus/data/cc/svg/IKJ.svg) | 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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![IO6 IO6](https://data.pdbj.org/pdbjplus/data/cc/svg/IO6.svg) | 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 IO8](https://data.pdbj.org/pdbjplus/data/cc/svg/IO8.svg) | 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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![IQ2 IQ2](https://data.pdbj.org/pdbjplus/data/cc/svg/IQ2.svg) | 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 IQE](https://data.pdbj.org/pdbjplus/data/cc/svg/IQE.svg) | 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 ITZ](https://data.pdbj.org/pdbjplus/data/cc/svg/ITZ.svg) | 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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![D8R D8R](https://data.pdbj.org/pdbjplus/data/cc/svg/D8R.svg) | D8R | Name: | (2~{S})-2-azanyl-6-[[(2~{R})-2-oxidanylpropanoyl]amino]hexanoic acid | Formula: | C9 H18 N2 O4 | SMILES: | C[CH](O)C(=O)NCCCC[CH](N)C(O)=O | InChi: | InChI=1S/C9H18N2O4/c1-6(12)8(13)11-5-3-2-4-7(10)9(14)15/h6-7,12H,2-5,10H2,1H3,(H,11,13)(H,14,15)/t6-,7+/m1/s1 | Definition date: | 2022-04-11 | Last modified: | 2023-11-03 | Release date: | 2023-05-10 | Identifier: | (2~{S})-2-azanyl-6-[[(2~{R})-2-oxidanylpropanoyl]amino]hexanoic acid |
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![DA2 DA2](https://data.pdbj.org/pdbjplus/data/cc/svg/DA2.svg) | DA2 | Name: | NG,NG-DIMETHYL-L-ARGININE | Formula: | C8 H18 N4 O2 | SMILES: | CN(C)C(/NCCCC(N)C(=O)O)=N | InChi: | InChI=1S/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1 | Synonyms: | ADMA | Definition date: | 1999-07-27 | Last modified: | 2023-11-03 | Identifier: | N~5~-(N,N-dimethylcarbamimidoyl)-L-ornithine |
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