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LWI
LWI
Name:2-(aminomethyl)-L-phenylalanine
Formula:C10 H14 N2 O2
SMILES:NC(Cc1ccccc1CN)C(O)=O
InChi:InChI=1S/C10H14N2O2/c11-6-8-4-2-1-3-7(8)5-9(12)10(13)14/h1-4,9H,5-6,11-12H2,(H,13,14)/t9-/m0/s1
Definition date:2020-06-09
Last modified:2023-11-03
Release date:2021-03-31
Identifier:2-(aminomethyl)-L-phenylalanine
LYV
LYV
Name:O-phosphono-L-seryl-N-[(3S)-3-amino-3-carboxypropyl]glycinamide
Formula:C9 H19 N4 O8 P
SMILES:O=P(OCC(C(=O)NCC(=O)NCCC(C(=O)O)N)N)(O)O
InChi:InChI=1S/C9H19N4O8P/c10-5(9(16)17)1-2-12-7(14)3-13-8(15)6(11)4-21-22(18,19)20/h5-6H,1-4,10-11H2,(H,12,14)(H,13,15)(H,16,17)(H2,18,19,20)/t5-,6-/m0/s1
Definition date:2013-12-06
Last modified:2023-11-03
Release date:2014-12-03
Identifier:O-phosphono-L-seryl-N-[(3S)-3-amino-3-carboxypropyl]glycinamide
M0H
M0H
Name:S-(HYDROXYMETHYL)-L-CYSTEINE
Formula:C4 H9 N O3 S
SMILES:O=C(O)C(N)CSCO
InChi:InChI=1S/C4H9NO3S/c5-3(4(7)8)1-9-2-6/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1
Definition date:2007-04-30
Last modified:2023-11-03
Identifier:S-(hydroxymethyl)-L-cysteine
200
200
Name:4-CHLORO-L-PHENYLALANINE
Formula:C9 H10 Cl N O2
SMILES:Clc1ccc(cc1)CC(C(=O)O)N
InChi:InChI=1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:2005-09-15
Last modified:2023-11-03
Identifier:4-chloro-L-phenylalanine
M2L
M2L
Name:(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acid
Formula:C7 H16 N2 O2 S
SMILES:O=C(O)C(N)CSCCN(C)C
InChi:InChI=1S/C7H16N2O2S/c1-9(2)3-4-12-5-6(8)7(10)11/h6H,3-5,8H2,1-2H3,(H,10,11)/t6-/m0/s1
Definition date:2008-04-09
Last modified:2023-11-03
Identifier:S-[2-(dimethylamino)ethyl]-L-cysteine
A30
A30
Name:O-ethyl-L-tyrosine
Formula:C11 H15 N O3
SMILES:CCOc1ccc(cc1)CC(N)C(=O)O
InChi:InChI=1S/C11H15NO3/c1-2-15-9-5-3-8(4-6-9)7-10(12)11(13)14/h3-6,10H,2,7,12H2,1H3,(H,13,14)/t10-/m0/s1
Definition date:2021-11-04
Last modified:2023-11-03
Release date:2022-06-01
Identifier:O-ethyl-L-tyrosine
A3U
A3U
Name:4-acetamido-L-phenylalanine
Formula:C11 H14 N2 O3
SMILES:O=C(C)Nc1ccc(cc1)CC(N)C(=O)O
InChi:InChI=1S/C11H14N2O3/c1-7(14)13-9-4-2-8(3-5-9)6-10(12)11(15)16/h2-5,10H,6,12H2,1H3,(H,13,14)(H,15,16)/t10-/m0/s1
Definition date:2021-11-04
Last modified:2023-11-03
Release date:2022-06-01
Identifier:4-acetamido-L-phenylalanine
MA
MA
Name:METHYL L-ALANINATE
Formula:C4 H9 N O2
SMILES:O=C(OC)C(N)C
InChi:InChI=1S/C4H9NO2/c1-3(5)4(6)7-2/h3H,5H2,1-2H3/t3-/m0/s1
Definition date:2008-07-10
Last modified:2023-11-03
Identifier:methyl L-alaninate
MAA
MAA
Name:N-methyl-L-alanine
Formula:C4 H9 N O2
SMILES:O=C(O)C(NC)C
InChi:InChI=1S/C4H9NO2/c1-3(5-2)4(6)7/h3,5H,1-2H3,(H,6,7)/t3-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:N-methyl-L-alanine
MBQ
MBQ
Name:2-HYDROXY-5-({1-[(4-METHYLPHENOXY)METHYL]-3-OXOPROP-1-ENYL}AMINO)-L-TYROSINE
Formula:C20 H22 N2 O6
SMILES:O=C(O)C(N)Cc2c(O)cc(O)c(NC(=CC=O)COc1ccc(cc1)C)c2
InChi:InChI=1S/C20H22N2O6/c1-12-2-4-15(5-3-12)28-11-14(6-7-23)22-17-9-13(8-16(21)20(26)27)18(24)10-19(17)25/h2-7,9-10,16,22,24-25H,8,11,21H2,1H3,(H,26,27)/b14-6+/t16-/m0/s1
Definition date:2004-03-04
Last modified:2023-11-03
Identifier:2-hydroxy-5-({(1E)-1-[(4-methylphenoxy)methyl]-3-oxoprop-1-en-1-yl}amino)-L-tyrosine
MCS
MCS
Name:MALONYL CYSTEINE
Formula:C6 H9 N O5 S
SMILES:O=C(O)C(N)CSC(=O)CC(=O)O
InChi:InChI=1S/C6H9NO5S/c7-3(6(11)12)2-13-5(10)1-4(8)9/h3H,1-2,7H2,(H,8,9)(H,11,12)/t3-/m0/s1
Definition date:2007-02-02
Last modified:2023-11-03
Identifier:S-(carboxyacetyl)-L-cysteine
MEA
MEA
Name:N-METHYLPHENYLALANINE
Formula:C10 H13 N O2
SMILES:O=C(O)C(NC)Cc1ccccc1
InChi:InChI=1S/C10H13NO2/c1-11-9(10(12)13)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3,(H,12,13)/t9-/m0/s1
Definition date:2002-06-19
Last modified:2023-11-03
Identifier:N-methyl-L-phenylalanine
MF0
MF0
Name:(2R)-2-(5-chloropyridin-3-yl)-N-(4-methylpyridin-3-yl)propanamide
Formula:C14 H14 Cl N3 O
SMILES:O=C(Nc1cnccc1C)C(C)c1cc(Cl)cnc1
InChi:InChI=1S/C14H14ClN3O/c1-9-3-4-16-8-13(9)18-14(19)10(2)11-5-12(15)7-17-6-11/h3-8,10H,1-2H3,(H,18,19)/t10-/m1/s1
Definition date:2023-08-15
Last modified:2023-11-03
Release date:2023-11-08
Identifier:(2R)-2-(5-chloropyridin-3-yl)-N-(4-methylpyridin-3-yl)propanamide
MGG
MGG
Name:2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-PENTANOIC ACID
Formula:C9 H17 N4 O5
SMILES:O=C(NC(C(=O)O)CCCNC(=[NH2+])N)CC(=O)O
InChi:InChI=1S/C9H16N4O5/c10-9(11)12-3-1-2-5(8(17)18)13-6(14)4-7(15)16/h5H,1-4H2,(H,13,14)(H,15,16)(H,17,18)(H4,10,11,12)/p+1/t5-/m1/s1
Synonyms:D-ARGININE WITH 3-OXO-PROPIONIC ACID MODIFICATION
Definition date:1999-08-25
Last modified:2023-11-03
Identifier:amino({(4R)-4-carboxy-4-[(carboxyacetyl)amino]butyl}amino)methaniminium
MH6
MH6
Name:3-hydroxy-2-iminopropanoic acid
Formula:C3 H5 N O3
SMILES:O=C(O)C(=[N@H])CO
InChi:InChI=1S/C3H5NO3/c4-2(1-5)3(6)7/h4-5H,1H2,(H,6,7)/b4-2+
Definition date:2008-03-11
Last modified:2023-11-03
Identifier:(2E)-3-hydroxy-2-iminopropanoic acid
MHS
MHS
Name:N1-METHYLATED HISTIDINE
Formula:C7 H11 N3 O2
SMILES:O=C(O)C(N)Cc1cncn1C
InChi:InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:3-methyl-L-histidine
MHU
MHU
Name:4-N,N-(DIMETHYLAMINO)-L-PHENYLALANINE
Formula:C12 H18 N2 O2
SMILES:O=C(O)C(NC)Cc1ccc(N(C)C)cc1
InChi:InChI=1S/C12H18N2O2/c1-13-11(12(15)16)8-9-4-6-10(7-5-9)14(2)3/h4-7,11,13H,8H2,1-3H3,(H,15,16)/t11-/m0/s1
Definition date:2010-07-15
Last modified:2023-11-03
Identifier:4-(dimethylamino)-N-methyl-L-phenylalanine
7C9
7C9
Name:O-methyl-L-serine
Formula:C4 H9 N O3
SMILES:O(CC(N)C(=O)O)C
InChi:InChI=1S/C4H9NO3/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
Definition date:2016-10-03
Last modified:2023-11-03
Release date:2017-01-11
Identifier:O-methyl-L-serine
MN8
MN8
Name:2-(4-CARCOXY-5-ISOPROPYLTHIAZOLYL)BENZOPIPERIDINE
Formula:C16 H18 N2 O2 S
SMILES:O=C(O)c1nc(sc1C(C)C)C3NCc2ccccc2C3
InChi:InChI=1S/C16H18N2O2S/c1-9(2)14-13(16(19)20)18-15(21-14)12-7-10-5-3-4-6-11(10)8-17-12/h3-6,9,12,17H,7-8H2,1-2H3,(H,19,20)/t12-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:5-(1-methylethyl)-2-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]-1,3-thiazole-4-carboxylic acid
MPR
MPR
Name:2-MERCAPTO-PROPION ALDEHYDE
Formula:C3 H6 O S
SMILES:O=CCCS
InChi:InChI=1S/C3H6OS/c4-2-1-3-5/h2,5H,1,3H2
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:3-sulfanylpropanal
MPT
MPT
Name:BETA-MERCAPTOPROPIONIC ACID
Formula:C3 H6 O2 S
SMILES:O=C(O)CCS
InChi:InChI=1S/C3H6O2S/c4-3(5)1-2-6/h6H,1-2H2,(H,4,5)
Definition date:2001-01-26
Last modified:2023-11-03
Identifier:3-sulfanylpropanoic acid
MQ3
MQ3
Name:(2R)-2-cyclohexyl-N-(4-methylpyridin-3-yl)propanamide
Formula:C15 H22 N2 O
SMILES:O=C(Nc1cnccc1C)C(C)C1CCCCC1
InChi:InChI=1S/C15H22N2O/c1-11-8-9-16-10-14(11)17-15(18)12(2)13-6-4-3-5-7-13/h8-10,12-13H,3-7H2,1-2H3,(H,17,18)/t12-/m1/s1
Definition date:2023-08-16
Last modified:2023-11-03
Release date:2023-11-08
Identifier:(2R)-2-cyclohexyl-N-(4-methylpyridin-3-yl)propanamide
MTY
MTY
Name:META-TYROSINE
Formula:C9 H11 N O3
SMILES:O=C(O)C(N)Cc1cc(O)ccc1
InChi:InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-2-1-3-7(11)4-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:3-hydroxy-L-phenylalanine
9VA
9VA
Name:3-[(2S,5S)-5-(hydroxymethyl)-6-oxo-1,2,5,6-tetrahydropyrazin-2-yl]propanamide
Formula:C8 H13 N3 O3
SMILES:C1=NC(CO)C(NC1CCC(=O)N)=O
InChi:InChI=1S/C8H13N3O3/c9-7(13)2-1-5-3-10-6(4-12)8(14)11-5/h3,5-6,12H,1-2,4H2,(H2,9,13)(H,11,14)/t5-,6-/m0/s1
Definition date:2017-06-13
Last modified:2023-11-03
Release date:2017-08-30
Identifier:3-[(2S,5S)-5-(hydroxymethyl)-6-oxo-1,2,5,6-tetrahydropyrazin-2-yl]propanamide
9WV
9WV
Name:beta-alanyl-3-amino-L-alanine
Formula:C6 H13 N3 O3
SMILES:NCC(NC(=O)CCN)C(O)=O
InChi:InChI=1S/C6H13N3O3/c7-2-1-5(10)9-4(3-8)6(11)12/h4H,1-3,7-8H2,(H,9,10)(H,11,12)/t4-/m0/s1
Definition date:2017-06-20
Last modified:2023-11-03
Release date:2017-10-04
Identifier:beta-alanyl-3-amino-L-alanine

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数据于2024-08-07公开中

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