| ZDJ | Name: | 3-methyl-L-tyrosine | Formula: | C10 H13 N O3 | SMILES: | Cc1cc(CC(N)C(=O)O)ccc1O | InChi: | InChI=1S/C10H13NO3/c1-6-4-7(2-3-9(6)12)5-8(11)10(13)14/h2-4,8,12H,5,11H2,1H3,(H,13,14)/t8-/m0/s1 | Definition date: | 2021-04-15 | Last modified: | 2023-11-03 | Release date: | 2021-12-29 | Identifier: | 3-methyl-L-tyrosine |
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| 0MG | Name: | amino{[(4S)-4-amino-5-carboxy-5-oxopentyl]amino}methaniminium | Formula: | C7 H15 N4 O3 | SMILES: | O=C(C(=O)O)C(N)CCCNC(=[NH2+])N | InChi: | InChI=1S/C7H14N4O3/c8-4(5(12)6(13)14)2-1-3-11-7(9)10/h4H,1-3,8H2,(H,13,14)(H4,9,10,11)/p+1/t4-/m0/s1 | Definition date: | 2010-09-24 | Last modified: | 2023-11-03 | Identifier: | amino{[(4S)-4-amino-5-carboxy-5-oxopentyl]amino}methaniminium |
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| VYN | Name: | 8-(4-azanylbutyl)-2-[1,3-bis(oxidanyl)propan-2-ylamino]-6-[2-chloranyl-4-(6-methylpyridin-2-yl)phenyl]pyrido[2,3-d]pyrimidin-7-one | Formula: | C26 H29 Cl N6 O3 | SMILES: | Cc1cccc(n1)c2ccc(c(Cl)c2)C3=Cc4cnc(NC(CO)CO)nc4N(CCCCN)C3=O | InChi: | InChI=1S/C26H29ClN6O3/c1-16-5-4-6-23(30-16)17-7-8-20(22(27)12-17)21-11-18-13-29-26(31-19(14-34)15-35)32-24(18)33(25(21)36)10-3-2-9-28/h4-8,11-13,19,34-35H,2-3,9-10,14-15,28H2,1H3,(H,29,31,32) | Definition date: | 2023-09-20 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | 8-(4-azanylbutyl)-2-[1,3-bis(oxidanyl)propan-2-ylamino]-6-[2-chloranyl-4-(6-methylpyridin-2-yl)phenyl]pyrido[2,3-d]pyrimidin-7-one |
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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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| XDD | Name: | N-[(1S,2S)-2-aminocyclopentyl]-N-[(6-amino-9H-purin-9-yl)acetyl]glycine | Formula: | C14 H19 N7 O3 | SMILES: | C(n1cnc2c1ncnc2N)C(=O)N(CC(O)=O)C3CCCC3N | InChi: | InChI=1S/C14H19N7O3/c15-8-2-1-3-9(8)21(5-11(23)24)10(22)4-20-7-19-12-13(16)17-6-18-14(12)20/h6-9H,1-5,15H2,(H,23,24)(H2,16,17,18)/t8-,9-/m0/s1 | Definition date: | 2020-12-11 | Last modified: | 2023-11-03 | Release date: | 2020-12-23 | Identifier: | N-[(1S,2S)-2-aminocyclopentyl]-N-[(6-amino-9H-purin-9-yl)acetyl]glycine |
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| KJW | Name: | (d)3-hydroxy-Leucine | Formula: | C6 H13 N O3 | SMILES: | CC(C)[CH](O)[CH](N)C(O)=O | InChi: | InChI=1S/C6H13NO3/c1-3(2)5(8)4(7)6(9)10/h3-5,8H,7H2,1-2H3,(H,9,10)/t4-,5+/m1/s1 | Definition date: | 2019-05-28 | Last modified: | 2023-11-03 | Release date: | 2020-07-08 | Identifier: | (2~{R},3~{S})-2-azanyl-4-methyl-3-oxidanyl-pentanoic acid |
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| V4F | Name: | 8-(aminomethyl)-4-(phosphonomethoxy)quinoline-2-carboxylic acid | Formula: | C12 H13 N2 O6 P | SMILES: | NCc1cccc2c(OC[P](O)(O)=O)cc(nc12)C(O)=O | InChi: | InChI=1S/C12H13N2O6P/c13-5-7-2-1-3-8-10(20-6-21(17,18)19)4-9(12(15)16)14-11(7)8/h1-4H,5-6,13H2,(H,15,16)(H2,17,18,19) | Definition date: | 2023-02-21 | Last modified: | 2023-11-03 | Release date: | 2023-07-19 | Identifier: | 8-(aminomethyl)-4-(phosphonomethoxy)quinoline-2-carboxylic acid |
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| XDJ | Name: | N-[(1S,2S)-2-aminocyclopentyl]-N-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)acetyl]glycine | Formula: | C14 H19 N7 O4 | SMILES: | C(O)(CN(C1C(N)CCC1)C(Cn2cnc3c2N=C(N)NC3=O)=O)=O | InChi: | InChI=1S/C14H19N7O4/c15-7-2-1-3-8(7)21(5-10(23)24)9(22)4-20-6-17-11-12(20)18-14(16)19-13(11)25/h6-8H,1-5,15H2,(H,23,24)(H3,16,18,19,25)/t7-,8-/m0/s1 | Definition date: | 2020-12-11 | Last modified: | 2023-11-03 | Release date: | 2020-12-23 | Identifier: | N-[(1S,2S)-2-aminocyclopentyl]-N-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)acetyl]glycine |
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| VZ2 | Name: | 8-(4-azanylbutyl)-6-[2-chloranyl-4-(6-methylpyridin-2-yl)phenyl]-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]pyrido[2,3-d]pyrimidin-7-one | Formula: | C30 H34 Cl N7 O2 | SMILES: | Cc1cccc(n1)c2ccc(c(Cl)c2)C3=Cc4cnc(NCCCN5CCCC5=O)nc4N(CCCCN)C3=O | InChi: | InChI=1S/C30H34ClN7O2/c1-20-7-4-8-26(35-20)21-10-11-23(25(31)18-21)24-17-22-19-34-30(33-13-6-15-37-14-5-9-27(37)39)36-28(22)38(29(24)40)16-3-2-12-32/h4,7-8,10-11,17-19H,2-3,5-6,9,12-16,32H2,1H3,(H,33,34,36) | Definition date: | 2023-09-20 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | 8-(4-azanylbutyl)-6-[2-chloranyl-4-(6-methylpyridin-2-yl)phenyl]-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]pyrido[2,3-d]pyrimidin-7-one |
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| XDV | Name: | 2-[2-(2-aminoethoxy)ethoxy]acetamide | Formula: | C6 H14 N2 O3 | SMILES: | NC(COCCOCCN)=O | InChi: | InChI=1S/C6H14N2O3/c7-1-2-10-3-4-11-5-6(8)9/h1-5,7H2,(H2,8,9) | Definition date: | 2020-12-11 | Last modified: | 2023-11-03 | Release date: | 2020-12-23 | Identifier: | 2-[2-(2-aminoethoxy)ethoxy]acetamide |
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| XDY | Name: | N-[(1S,2S)-2-aminocyclopentyl]-N-[(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetyl]glycine | Formula: | C14 H20 N4 O5 | SMILES: | C(CN(C1C(N)CCC1)C(=O)CN2C(NC(=O)C(C)=C2)=O)(O)=O | InChi: | InChI=1S/C14H20N4O5/c1-8-5-17(14(23)16-13(8)22)6-11(19)18(7-12(20)21)10-4-2-3-9(10)15/h5,9-10H,2-4,6-7,15H2,1H3,(H,20,21)(H,16,22,23)/t9-,10-/m0/s1 | Definition date: | 2020-12-11 | Last modified: | 2023-11-03 | Release date: | 2020-12-23 | Identifier: | N-[(1S,2S)-2-aminocyclopentyl]-N-[(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetyl]glycine |
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| 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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| YCM | Name: | S-(2-AMINO-2-OXOETHYL)-L-CYSTEINE | Formula: | C5 H10 N2 O3 S | SMILES: | O=C(O)C(N)CSCC(=O)N | InChi: | InChI=1S/C5H10N2O3S/c6-3(5(9)10)1-11-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 | Synonyms: | CYSTEINE-S-ACETAMIDE | Definition date: | 2002-02-18 | Last modified: | 2023-11-03 | Identifier: | S-(2-amino-2-oxoethyl)-L-cysteine |
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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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| UQ0 | Name: | 2,3-DIMETHOXY-5-METHYL-1,4-BENZOQUINONE | Formula: | C9 H10 O4 | SMILES: | O=C1C=C(C(=O)C(OC)=C1OC)C | InChi: | InChI=1S/C9H10O4/c1-5-4-6(10)8(12-2)9(13-3)7(5)11/h4H,1-3H3 | Definition date: | 2011-11-26 | Last modified: | 2023-11-03 | Release date: | 2023-11-08 | Identifier: | 2,3-dimethoxy-5-methylcyclohexa-2,5-diene-1,4-dione |
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| YCP | Name: | (2S)-piperidine-2-carboxylic acid | Formula: | C6 H11 N O2 | SMILES: | OC(=O)[CH]1CCCCN1 | InChi: | InChI=1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1 | Definition date: | 2010-01-07 | Last modified: | 2023-11-03 | Identifier: | (2S)-piperidine-2-carboxylic acid |
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| UQ4 | Name: | N-(7-nitro-2,1,3-benzoxadiazol-4-yl)-beta-alanine | Formula: | C9 H8 N4 O5 | SMILES: | C(=O)(CCNc1c2c(c(cc1)N(=O)=O)non2)O | InChi: | InChI=1S/C9H8N4O5/c14-7(15)3-4-10-5-1-2-6(13(16)17)9-8(5)11-18-12-9/h1-2,10H,3-4H2,(H,14,15) | Definition date: | 2020-05-27 | Last modified: | 2023-11-03 | Release date: | 2020-06-03 | Identifier: | N-(7-nitro-2,1,3-benzoxadiazol-4-yl)-beta-alanine |
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| XW1 | Name: | (2S)-2-amino-7-ethoxy-7-oxoheptanoic acid | Formula: | C9 H17 N O4 | SMILES: | O=C(OCC)CCCCC(C(=O)O)N | InChi: | InChI=1S/C9H17NO4/c1-2-14-8(11)6-4-3-5-7(10)9(12)13/h7H,2-6,10H2,1H3,(H,12,13)/t7-/m0/s1 | Definition date: | 2011-06-14 | Last modified: | 2023-11-03 | Identifier: | (2S)-2-amino-7-ethoxy-7-oxoheptanoic 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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| TXY | Name: | 3-[(5S)-4,5-dihydroxycyclohexa-1,3-dien-1-yl]-L-alanine | Formula: | C9 H13 N O4 | SMILES: | O=C(O)C(N)CC1=CC=C(O)C(O)C1 | InChi: | InChI=1S/C9H13NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,6,8,11-12H,3-4,10H2,(H,13,14)/t6-,8-/m0/s1 | Definition date: | 2013-05-27 | Last modified: | 2023-11-03 | Release date: | 2014-06-25 | Identifier: | 3-[(5S)-4,5-dihydroxycyclohexa-1,3-dien-1-yl]-L-alanine |
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| JBY | Name: | (2S)-2-{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}propanoic acid | Formula: | C14 H15 N3 O4 | SMILES: | C1(=NC(C(=O)N1C(C(=O)O)C)=C/c2ccc(O)cc2)CN | InChi: | InChI=1S/C14H15N3O4/c1-8(14(20)21)17-12(7-15)16-11(13(17)19)6-9-2-4-10(18)5-3-9/h2-6,8,18H,7,15H2,1H3,(H,20,21)/b11-6-/t8-/m0/s1 | Synonyms: | Gly-Ala-Try Chromophore | Definition date: | 2018-08-29 | Last modified: | 2023-11-03 | Release date: | 2019-03-13 | Identifier: | (2S)-2-{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}propanoic acid |
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| TY1 | Name: | O-tert-butyl-L-tyrosine | Formula: | C13 H19 N O3 | SMILES: | O=C(O)C(N)Cc1ccc(OC(C)(C)C)cc1 | InChi: | InChI=1S/C13H19NO3/c1-13(2,3)17-10-6-4-9(5-7-10)8-11(14)12(15)16/h4-7,11H,8,14H2,1-3H3,(H,15,16)/t11-/m0/s1 | Definition date: | 2010-10-06 | Last modified: | 2023-11-03 | Identifier: | O-tert-butyl-L-tyrosine |
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| YTF | Name: | ethyl (4~{S})-4,7-bis(azanyl)-7-oxidanylidene-heptanoate | Formula: | C9 H18 N2 O3 | SMILES: | CCOC(=O)CC[CH](N)CCC(N)=O | InChi: | InChI=1S/C9H18N2O3/c1-2-14-9(13)6-4-7(10)3-5-8(11)12/h7H,2-6,10H2,1H3,(H2,11,12)/t7-/m0/s1 | Definition date: | 2023-02-21 | Last modified: | 2023-11-03 | Release date: | 2023-03-01 | Identifier: | ethyl (4~{S})-4,7-bis(azanyl)-7-oxidanylidene-heptanoate |
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| TY2 | Name: | 3-AMINO-L-TYROSINE | Formula: | C9 H12 N2 O3 | SMILES: | O=C(O)C(N)Cc1ccc(O)c(N)c1 | InChi: | InChI=1S/C9H12N2O3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,10-11H2,(H,13,14)/t7-/m0/s1 | Definition date: | 2007-11-17 | Last modified: | 2023-11-03 | Identifier: | 3-amino-L-tyrosine |
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| YTH | Name: | O-phosphono-L-allothreonine | Formula: | C4 H10 N O6 P | SMILES: | O=P(OC(C)C(N)C(=O)O)(O)O | InChi: | InChI=1S/C4H10NO6P/c1-2(3(5)4(6)7)11-12(8,9)10/h2-3H,5H2,1H3,(H,6,7)(H2,8,9,10)/t2-,3-/m0/s1 | Definition date: | 2014-10-07 | Last modified: | 2023-11-03 | Release date: | 2014-12-03 | Identifier: | O-phosphono-L-allothreonine |
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