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60F
60F
Name:(2~{R})-2-azanyl-3-[(~{E})-3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl-propanoic acid
Formula:C12 H13 N O4 S
SMILES:N[CH](CSC(=O)C=Cc1ccc(O)cc1)C(O)=O
InChi:InChI=1S/C12H13NO4S/c13-10(12(16)17)7-18-11(15)6-3-8-1-4-9(14)5-2-8/h1-6,10,14H,7,13H2,(H,16,17)/b6-3+/t10-/m0/s1
Definition date:2016-01-07
Last modified:2023-11-03
Release date:2016-05-18
Identifier:(2~{R})-2-azanyl-3-[(~{E})-3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl-propanoic acid
62H
62H
Name:(2S)-3-amino-2-methylpropanoic acid
Formula:C4 H9 N O2
SMILES:NCC(C(=O)O)C
InChi:InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
Definition date:2016-01-15
Last modified:2023-11-03
Release date:2016-02-24
Identifier:(2S)-3-amino-2-methylpropanoic acid
6CV
6CV
Name:3-bromo-L-phenylalanine
Formula:C9 H10 Br N O2
SMILES:Brc1cccc(CC(N)C(O)=O)c1
InChi:InChI=1S/C9H10BrNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:2016-03-15
Last modified:2023-11-03
Release date:2016-10-26
Identifier:3-bromo-L-phenylalanine
6CW
6CW
Name:6-CHLORO-L-TRYPTOPHAN
Formula:C11 H11 Cl N2 O2
SMILES:O=C(O)C(N)Cc2c1ccc(Cl)cc1nc2
InChi:InChI=1S/C11H11ClN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
Definition date:2005-09-22
Last modified:2023-11-03
Identifier:6-chloro-L-tryptophan
6DU
6DU
Name:2-bromo-L-phenylalanine
Formula:C9 H10 Br N O2
SMILES:O=C(C(N)Cc1c(Br)cccc1)O
InChi:InChI=1S/C9H10BrNO2/c10-7-4-2-1-3-6(7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:2016-03-17
Last modified:2023-11-03
Release date:2016-10-26
Identifier:2-bromo-L-phenylalanine
CGL
CGL
Name:CYSTINE-GLUTATHIONE
Formula:C13 H22 N4 O8 S2
SMILES:O=C(NC(C(=O)NCC(=O)O)CSSCC(C(=O)O)N)CCC(C(=O)O)N
InChi:InChI=1S/C13H22N4O8S2/c14-6(12(22)23)1-2-9(18)17-8(11(21)16-3-10(19)20)5-27-26-4-7(15)13(24)25/h6-8H,1-5,14-15H2,(H,16,21)(H,17,18)(H,19,20)(H,22,23)(H,24,25)
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:2-amino-5-({3-[(2-amino-2-carboxyethyl)disulfanyl]-1-[(carboxymethyl)amino]-1-oxopropan-2-yl}amino)-5-oxopentanoic acid (non-preferred name)
CGU
CGU
Name:GAMMA-CARBOXY-GLUTAMIC ACID
Formula:C6 H9 N O6
SMILES:O=C(O)C(C(=O)O)CC(N)C(=O)O
InChi:InChI=1S/C6H9NO6/c7-3(6(12)13)1-2(4(8)9)5(10)11/h2-3H,1,7H2,(H,8,9)(H,10,11)(H,12,13)/t3-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:(3S)-3-aminopropane-1,1,3-tricarboxylic acid
CME
CME
Name:S,S-(2-HYDROXYETHYL)THIOCYSTEINE
Formula:C5 H11 N O3 S2
SMILES:O=C(O)C(N)CSSCCO
InChi:InChI=1S/C5H11NO3S2/c6-4(5(8)9)3-11-10-2-1-7/h4,7H,1-3,6H2,(H,8,9)/t4-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:3-[(2-hydroxyethyl)disulfanyl]-L-alanine
CMT
CMT
Name:O-METHYLCYSTEINE
Formula:C4 H9 N O2 S
SMILES:O=C(OC)C(N)CS
InChi:InChI=1S/C4H9NO2S/c1-7-4(6)3(5)2-8/h3,8H,2,5H2,1H3/t3-/m0/s1
Definition date:2000-01-19
Last modified:2023-11-03
Identifier:methyl L-cysteinate
CNT
CNT
Name:N-METHYL-META-CHLORO-TYROSINE
Formula:C10 H12 Cl N O3
SMILES:Clc1cc(ccc1O)CC(C(=O)O)NC
InChi:InChI=1S/C10H12ClNO3/c1-12-8(10(14)15)5-6-2-3-9(13)7(11)4-6/h2-4,8,12-13H,5H2,1H3,(H,14,15)/t8-/m0/s1
Synonyms:N-METHYL-3-CHLORO-TYROSINE
Definition date:2003-07-31
Last modified:2023-11-03
Identifier:3-chloro-N-methyl-L-tyrosine
CPC
CPC
Name:2-METHYL-1-METHYLAMINO-CYCLOPROPANE CARBOXYLIC ACID
Formula:C6 H11 N O2
SMILES:O=C(O)C1(NC)CC1C
InChi:InChI=1S/C6H11NO2/c1-4-3-6(4,7-2)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-,6-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:(1S,2S)-2-methyl-1-(methylamino)cyclopropanecarboxylic acid
5CW
5CW
Name:5-chloro-L-tryptophan
Formula:C11 H11 Cl N2 O2
SMILES:O=C(O)C(N)Cc2c1cc(Cl)ccc1nc2
InChi:InChI=1S/C11H11ClN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
Definition date:2013-12-09
Last modified:2023-11-03
Release date:2014-03-05
Identifier:5-chloro-L-tryptophan
5DW
5DW
Name:4-ethynyl-L-phenylalanine
Formula:C11 H11 N O2
SMILES:C(c1ccc(CC(N)C(=O)O)cc1)#C
InChi:InChI=1S/C11H11NO2/c1-2-8-3-5-9(6-4-8)7-10(12)11(13)14/h1,3-6,10H,7,12H2,(H,13,14)/t10-/m0/s1
Definition date:2015-09-14
Last modified:2023-11-03
Release date:2016-02-03
Identifier:4-ethynyl-L-phenylalanine
5JP
5JP
Name:N-methyl-L-serine
Formula:C4 H9 N O3
SMILES:O=C(O)C(CO)NC
InChi:InChI=1S/C4H9NO3/c1-5-3(2-6)4(7)8/h3,5-6H,2H2,1H3,(H,7,8)/t3-/m0/s1
Definition date:2015-10-02
Last modified:2023-11-03
Release date:2015-10-28
Identifier:N-methyl-L-serine
3MY
3MY
Name:3-chloro-D-tyrosine
Formula:C9 H10 Cl N O3
SMILES:Clc1cc(ccc1O)CC(C(=O)O)N
InChi:InChI=1S/C9H10ClNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m1/s1
Definition date:2009-03-27
Last modified:2023-11-03
Identifier:3-chloro-D-tyrosine
3PA
3PA
Name:3-CYCLOPENTYL-PROPIONIC ACID
Formula:C8 H14 O2
SMILES:O=C(O)CCC1CCCC1
InChi:InChI=1S/C8H14O2/c9-8(10)6-5-7-3-1-2-4-7/h7H,1-6H2,(H,9,10)
Definition date:2000-08-08
Last modified:2023-11-03
Identifier:3-cyclopentylpropanoic acid
3PX
3PX
Name:(3S)-3-(propan-2-yloxy)-L-proline
Formula:C8 H15 N O3
SMILES:O=C(O)C1NCCC1OC(C)C
InChi:InChI=1S/C8H15NO3/c1-5(2)12-6-3-4-9-7(6)8(10)11/h5-7,9H,3-4H2,1-2H3,(H,10,11)/t6-,7-/m0/s1
Definition date:2011-04-26
Last modified:2023-11-03
Identifier:(3S)-3-(propan-2-yloxy)-L-proline
3TY
3TY
Name:3-[(3E)-3-(BENZYLHYDRAZONO)-4-HYDROXY-6-OXOCYCLOHEXA-1,4-DIEN-1-YL]-L-ALANINE
Formula:C16 H17 N3 O4
SMILES:O=C2C=C(O)/C(=N/NCc1ccccc1)C=C2CC(C(=O)O)N
InChi:InChI=1S/C16H17N3O4/c17-12(16(22)23)6-11-7-13(15(21)8-14(11)20)19-18-9-10-4-2-1-3-5-10/h1-5,7-8,12,18,21H,6,9,17H2,(H,22,23)/b19-13+/t12-/m0/s1
Definition date:2004-08-11
Last modified:2023-11-03
Identifier:3-[(3E)-3-(benzylhydrazono)-4-hydroxy-6-oxocyclohexa-1,4-dien-1-yl]-L-alanine
3V3
3V3
Name:1-amino-3,6,9,12-tetraoxapentadecan-15-oic acid
Formula:C11 H23 N O6
SMILES:O=C(O)CCOCCOCCOCCOCCN
InChi:InChI=1S/C11H23NO6/c12-2-4-16-6-8-18-10-9-17-7-5-15-3-1-11(13)14/h1-10,12H2,(H,13,14)
Definition date:2014-11-09
Last modified:2023-11-03
Release date:2015-02-11
Identifier:1-amino-3,6,9,12-tetraoxapentadecan-15-oic acid
3WS
3WS
Name:N,2-dimethyl-L-alanine
Formula:C5 H11 N O2
SMILES:O=C(O)C(NC)(C)C
InChi:InChI=1S/C5H11NO2/c1-5(2,6-3)4(7)8/h6H,1-3H3,(H,7,8)
Definition date:2014-12-01
Last modified:2023-11-03
Release date:2015-03-25
Identifier:N,2-dimethyl-L-alanine
3WU
3WU
Name:(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanoic acid
Formula:C9 H17 N O3
SMILES:O=C(O)C(C(OC)C1NCCC1)C
InChi:InChI=1S/C9H17NO3/c1-6(9(11)12)8(13-2)7-4-3-5-10-7/h6-8,10H,3-5H2,1-2H3,(H,11,12)/t6-,7+,8-/m1/s1
Definition date:2014-12-01
Last modified:2023-11-03
Release date:2015-03-25
Identifier:(2R,3R)-3-methoxy-2-methyl-3-[(2S)-pyrrolidin-2-yl]propanoic acid
3YM
3YM
Name:3-methoxy-L-tyrosine
Formula:C10 H13 N O4
SMILES:O=C(O)C(N)Cc1cc(OC)c(O)cc1
InChi:InChI=1S/C10H13NO4/c1-15-9-5-6(2-3-8(9)12)4-7(11)10(13)14/h2-3,5,7,12H,4,11H2,1H3,(H,13,14)/t7-/m0/s1
Definition date:2012-10-29
Last modified:2023-11-03
Release date:2013-10-30
Identifier:3-methoxy-L-tyrosine
7N8
7N8
Name:4-Borono-L-phenylalanine
Formula:C9 H12 B N O4
SMILES:N[CH](Cc1ccc(cc1)B(O)O)C(O)=O
InChi:InChI=1S/C9H12BNO4/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15/h1-4,8,14-15H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:2016-11-24
Last modified:2023-11-03
Release date:2017-10-11
Identifier:(2~{S})-2-azanyl-3-[4-(dihydroxyboranyl)phenyl]propanoic acid
7O5
7O5
Name:(2~{S})-2-azanyl-3-(2-sulfanylethanoylamino)propanoic acid
Formula:C5 H10 N2 O3 S
SMILES:N[CH](CNC(=O)CS)C(O)=O
InChi:InChI=1S/C5H10N2O3S/c6-3(5(9)10)1-7-4(8)2-11/h3,11H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
Definition date:2016-12-01
Last modified:2023-11-03
Release date:2020-05-27
Identifier:(2~{S})-2-azanyl-3-(2-sulfanylethanoylamino)propanoic acid
7T2
7T2
Name:(2S)-3-(4-chlorophenyl)-2-(methylamino)propanoic acid
Formula:C10 H12 Cl N O2
SMILES:CN[CH](Cc1ccc(Cl)cc1)C(O)=O
InChi:InChI=1S/C10H12ClNO2/c1-12-9(10(13)14)6-7-2-4-8(11)5-3-7/h2-5,9,12H,6H2,1H3,(H,13,14)/t9-/m0/s1
Definition date:2021-10-22
Last modified:2023-11-03
Release date:2023-07-26
Identifier:(2~{S})-3-(4-chlorophenyl)-2-(methylamino)propanoic acid

223532

数据于2024-08-07公开中

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