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HSO
HSO
Name:L-histidinol
Formula:C6 H12 N3 O
SMILES:NC(CO)Cc1[nH+]cnc1
InChi:InChI=1S/C6H11N3O/c7-5(3-10)1-6-2-8-4-9-6/h2,4-5,10H,1,3,7H2,(H,8,9)/p+1/t5-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:4-[(2S)-2-amino-3-hydroxypropyl]-1H-imidazol-3-ium
HSV
HSV
Name:L-histidinal
Formula:C6 H10 N3 O
SMILES:NC(C=O)Cc1[nH+]cnc1
InChi:InChI=1S/C6H9N3O/c7-5(3-10)1-6-2-8-4-9-6/h2-5H,1,7H2,(H,8,9)/p+1/t5-/m0/s1
Definition date:2015-06-17
Last modified:2023-11-03
Identifier:4-[(2S)-2-amino-3-oxopropyl]-1H-imidazol-3-ium
HT0
HT0
Name:(4R,5R)-5-(4-hydroxyphenyl)-2-oxo-1,3-oxazolidine-4-carboxylic acid
Formula:C10 H9 N O5
SMILES:O=C(O)C1NC(=O)OC1c1ccc(O)cc1
InChi:InChI=1S/C10H9NO5/c12-6-3-1-5(2-4-6)8-7(9(13)14)11-10(15)16-8/h1-4,7-8,12H,(H,11,15)(H,13,14)/t7-,8-/m1/s1
Definition date:2021-03-10
Last modified:2023-11-03
Release date:2022-12-07
Identifier:(4R,5R)-5-(4-hydroxyphenyl)-2-oxo-1,3-oxazolidine-4-carboxylic acid
28H
28H
Name:(2R,3R)-3-hydroxy-2,4-dimethylpentanoic acid
Formula:C7 H14 O3
SMILES:O=C(O)C(C)C(O)C(C)C
InChi:InChI=1S/C7H14O3/c1-4(2)6(8)5(3)7(9)10/h4-6,8H,1-3H3,(H,9,10)/t5-,6-/m1/s1
Definition date:2013-09-10
Last modified:2023-11-03
Release date:2014-05-21
Identifier:(2R,3R)-3-hydroxy-2,4-dimethylpentanoic acid
28K
28K
Name:(2E)-3-{(2S)-2-[(1R)-1-hydroxyethyl]oxiran-2-yl}prop-2-enoic acid
Formula:C7 H10 O4
SMILES:O=C(O)C=CC1(OC1)C(O)C
InChi:InChI=1S/C7H10O4/c1-5(8)7(4-11-7)3-2-6(9)10/h2-3,5,8H,4H2,1H3,(H,9,10)/b3-2+/t5?,7-/m0/s1
Definition date:2013-09-10
Last modified:2023-11-03
Release date:2014-05-21
Identifier:(2E)-3-{(2S)-2-[(1R)-1-hydroxyethyl]oxiran-2-yl}prop-2-enoic acid
HT7
HT7
Name:(3S)-3-AMINO-4-(1H-INDOL-3-YL)BUTANOIC ACID
Formula:C12 H14 N2 O2
SMILES:O=C(O)CC(N)Cc2c1ccccc1nc2
InChi:InChI=1S/C12H14N2O2/c13-9(6-12(15)16)5-8-7-14-11-4-2-1-3-10(8)11/h1-4,7,9,14H,5-6,13H2,(H,15,16)/t9-/m0/s1
Synonyms:BETA-HOMOTRYPTOPHAN
Definition date:2011-05-18
Last modified:2023-11-03
Identifier:(3S)-3-amino-4-(1H-indol-3-yl)butanoic acid
HTR
HTR
Name:BETA-HYDROXYTRYPTOPHANE
Formula:C11 H12 N2 O3
SMILES:O=C(O)C(N)C(O)c2c1ccccc1nc2
InChi:InChI=1S/C11H12N2O3/c12-9(11(15)16)10(14)7-5-13-8-4-2-1-3-6(7)8/h1-5,9-10,13-14H,12H2,(H,15,16)/t9-,10-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:(betaS)-beta-hydroxy-L-tryptophan
HTY
HTY
Name:(betaR)-beta-hydroxy-D-tyrosine
Formula:C9 H11 N O4
SMILES:O=C(O)C(N)C(O)c1ccc(O)cc1
InChi:InChI=1S/C9H11NO4/c10-7(9(13)14)8(12)5-1-3-6(11)4-2-5/h1-4,7-8,11-12H,10H2,(H,13,14)/t7-,8-/m1/s1
Definition date:2002-09-02
Last modified:2023-11-03
Identifier:(betaR)-beta-hydroxy-D-tyrosine
2A1
2A1
Name:(2S)-2-aminopropan-1-ol
Formula:C3 H9 N O
SMILES:C[CH](N)CO
InChi:InChI=1S/C3H9NO/c1-3(4)2-5/h3,5H,2,4H2,1H3/t3-/m0/s1
Definition date:2010-01-06
Last modified:2023-11-03
Identifier:(2S)-2-azanylpropan-1-ol
HY1
HY1
Name:PHENYLACETALDEHYDE
Formula:C8 H8 O
SMILES:O=CCc1ccccc1
InChi:InChI=1S/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H2
Definition date:1999-08-26
Last modified:2023-11-03
Identifier:phenylacetaldehyde
I0C
I0C
Name:(2~{S})-4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[[9-[(2~{R},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-7~{H}-purin-6-yl]amino]propyl]amino]-2-azanyl-butanoic acid
Formula:
SMILES:N[CH](CCN(CCCNc1ncnc2n(cnc12)C3OC(CO)C(O)C3O)C[CH]4O[CH]([CH](O)[CH]4O)n5cnc6c(N)ncnc56)C(O)=O
InChi:InChI=1S/C27H38N12O9/c28-12(27(45)46)2-5-37(6-13-17(41)19(43)25(47-13)38-10-35-15-21(29)31-8-33-23(15)38)4-1-3-30-22-16-24(34-9-32-22)39(11-36-16)26-20(44)18(42)14(7-40)48-26/h8-14,17-20,25-26,40-44H,1-7,28H2,(H,45,46)(H2,29,31,33)(H,30,32,34)/t12-,13+,14?,17+,18?,19+,20?,25+,26?/m0/s1
Definition date:2023-07-24
Last modified:2023-11-03
Release date:2023-11-08
Identifier:(2~{S})-4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[[9-[(2~{R},3~{R},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]propyl]amino]-2-azanyl-butanoic acid
004
004
Name:(2S)-amino(phenyl)ethanoic acid
Formula:C8 H9 N O2
SMILES:O=C(O)C(N)c1ccccc1
InChi:InChI=1S/C8H9NO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,9H2,(H,10,11)/t7-/m0/s1
Synonyms:L-Phenylglycine
Definition date:2010-04-27
Last modified:2023-11-03
Identifier:(2S)-amino(phenyl)ethanoic acid
00E
00E
Name:morpholin-4-ylacetic acid
Formula:C6 H11 N O3
SMILES:O=C(O)CN1CCOCC1
InChi:InChI=1S/C6H11NO3/c8-6(9)5-7-1-3-10-4-2-7/h1-5H2,(H,8,9)
Definition date:2010-04-27
Last modified:2023-11-03
Identifier:morpholin-4-ylacetic acid
00I
00I
Name:N-[(1R)-1-(4-carbamimidoylbenzyl)-2-oxo-2-piperidin-1-ylethyl]-N~2~-(naphthalen-2-ylsulfonyl)-L-alpha-glutamine
Formula:C30 H35 N5 O6 S
SMILES:O=C(N1CCCCC1)C(NC(=O)C(NS(=O)(=O)c3cc2ccccc2cc3)CCC(=O)O)Cc4ccc(C(=[N@H])N)cc4
InChi:InChI=1S/C30H35N5O6S/c31-28(32)22-10-8-20(9-11-22)18-26(30(39)35-16-4-1-5-17-35)33-29(38)25(14-15-27(36)37)34-42(40,41)24-13-12-21-6-2-3-7-23(21)19-24/h2-3,6-13,19,25-26,34H,1,4-5,14-18H2,(H3,31,32)(H,33,38)(H,36,37)/t25-,26+/m0/s1
Definition date:2010-10-19
Last modified:2023-11-03
Identifier:N-[(2R)-3-(4-carbamimidoylphenyl)-1-oxo-1-(piperidin-1-yl)propan-2-yl]-N~2~-(naphthalen-2-ylsulfonyl)-L-alpha-glutamine
00S
00S
Name:4-(aminomethyl)benzenecarboximidamide
Formula:C8 H11 N3
SMILES:[N@H]=C(c1ccc(cc1)CN)N
InChi:InChI=1S/C8H11N3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5,9H2,(H3,10,11)
Definition date:2010-11-12
Last modified:2023-11-03
Identifier:4-(aminomethyl)benzenecarboximidamide
010
010
Name:phenylmethanol
Formula:C7 H8 O
SMILES:OCc1ccccc1
InChi:InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
Definition date:2010-11-15
Last modified:2023-11-03
Release date:2013-12-25
Identifier:phenylmethanol
011
011
Name:7-aminoheptanoic acid
Formula:C7 H15 N O2
SMILES:O=C(O)CCCCCCN
InChi:InChI=1S/C7H15NO2/c8-6-4-2-1-3-5-7(9)10/h1-6,8H2,(H,9,10)
Definition date:2010-11-16
Last modified:2023-11-03
Identifier:7-aminoheptanoic acid
01B
01B
Name:(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoic acid
Formula:C10 H13 N O3
SMILES:O=C(O)C(O)C(N)Cc1ccccc1
InChi:InChI=1S/C10H13NO3/c11-8(9(12)10(13)14)6-7-4-2-1-3-5-7/h1-5,8-9,12H,6,11H2,(H,13,14)/t8-,9+/m1/s1
Definition date:2010-06-18
Last modified:2023-11-03
Identifier:(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoic acid
V7T
V7T
Name:(2R)-6-azanyl-2-carbamimidamido-hexanoic acid
Formula:C7 H16 N4 O2
SMILES:NCCCC[CH](NC(N)=N)C(O)=O
InChi:InChI=1S/C7H16N4O2/c8-4-2-1-3-5(6(12)13)11-7(9)10/h5H,1-4,8H2,(H,12,13)(H4,9,10,11)/t5-/m1/s1
Definition date:2021-04-23
Last modified:2023-11-03
Release date:2022-04-06
Identifier:(2~{R})-6-azanyl-2-carbamimidamido-hexanoic acid
02G
02G
Name:(3S,4E)-3-hydroxy-7-sulfanylhept-4-enoic acid
Formula:C7 H12 O3 S
SMILES:O=C(O)CC(O)/C=C/CCS
InChi:InChI=1S/C7H12O3S/c8-6(5-7(9)10)3-1-2-4-11/h1,3,6,8,11H,2,4-5H2,(H,9,10)/b3-1+/t6-/m1/s1
Definition date:2011-05-04
Last modified:2023-11-03
Identifier:(3S,4E)-3-hydroxy-7-sulfanylhept-4-enoic acid
V8N
V8N
Name:2-[3-(aminomethyl)phenyl]ethanoic acid
Formula:C9 H11 N O2
SMILES:NCc1cccc(CC(O)=O)c1
InChi:InChI=1S/C9H11NO2/c10-6-8-3-1-2-7(4-8)5-9(11)12/h1-4H,5-6,10H2,(H,11,12)
Definition date:2021-04-29
Last modified:2023-11-03
Release date:2022-04-06
Identifier:2-[3-(aminomethyl)phenyl]ethanoic acid
02K
02K
Name:1-aminocyclohexanecarboxylic acid
Formula:C7 H13 N O2
SMILES:O=C(O)C1(N)CCCCC1
InChi:InChI=1S/C7H13NO2/c8-7(6(9)10)4-2-1-3-5-7/h1-5,8H2,(H,9,10)
Definition date:2011-06-15
Last modified:2023-11-03
Identifier:1-aminocyclohexanecarboxylic acid
02V
02V
Name:(2S)-(3,4-dihydroxyphenyl)(methylamino)ethanoic acid
Formula:C9 H11 N O4
SMILES:O=C(O)C(c1cc(O)c(O)cc1)NC
InChi:InChI=1S/C9H11NO4/c1-10-8(9(13)14)5-2-3-6(11)7(12)4-5/h2-4,8,10-12H,1H3,(H,13,14)/t8-/m0/s1
Definition date:2011-06-10
Last modified:2023-11-03
Identifier:(2S)-(3,4-dihydroxyphenyl)(methylamino)ethanoic acid
V9C
V9C
Name:2-phenylethylcarbamic acid
Formula:C9 H11 N O2
SMILES:OC(=O)NCCc1ccccc1
InChi:InChI=1S/C9H11NO2/c11-9(12)10-7-6-8-4-2-1-3-5-8/h1-5,10H,6-7H2,(H,11,12)
Definition date:2017-01-09
Last modified:2023-11-03
Release date:2017-11-15
Identifier:2-phenylethylcarbamic acid
03E
03E
Name:1-aminocycloheptanecarboxylic acid
Formula:C8 H15 N O2
SMILES:O=C(O)C1(N)CCCCCC1
InChi:InChI=1S/C8H15NO2/c9-8(7(10)11)5-3-1-2-4-6-8/h1-6,9H2,(H,10,11)
Definition date:2011-08-14
Last modified:2023-11-03
Identifier:1-aminocycloheptanecarboxylic acid

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