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SGB
SGB
Name:O-[(S)-METHYL(1-METHYLETHOXY)PHOSPHORYL]-L-SERINE
Formula:C7 H16 N O5 P
SMILES:O=P(OCC(N)C(=O)O)(OC(C)C)C
InChi:InChI=1S/C7H16NO5P/c1-5(2)13-14(3,11)12-4-6(8)7(9)10/h5-6H,4,8H2,1-3H3,(H,9,10)/t6-,14-/m0/s1
Definition date:2007-02-13
Last modified:2024-09-27
Identifier:O-[(S)-methyl(1-methylethoxy)phosphoryl]-L-serine
SGL
SGL
Name:1-HYDROXY-1-THIO-GLYCEROL
Formula:C3 H8 O3 S
SMILES:OCC(O)CSO
InChi:InChI=1S/C3H8O3S/c4-1-3(5)2-7-6/h3-6H,1-2H2/t3-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:(2R)-2,3-dihydroxypropane-1-sulfenic acid
SGM
SGM
Name:MONOTHIOGLYCEROL
Formula:C3 H8 O2 S
SMILES:OCC(O)CS
InChi:InChI=1S/C3H8O2S/c4-1-3(5)2-6/h3-6H,1-2H2/t3-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:(2R)-3-sulfanylpropane-1,2-diol
SGR
SGR
Name:O-[(R)-AMINO(METHOXY)PHOSPHORYL]-L-SERINE
Formula:C4 H11 N2 O5 P
SMILES:O=P(OC)(OCC(N)C(=O)O)N
InChi:InChI=1S/C4H11N2O5P/c1-10-12(6,9)11-2-3(5)4(7)8/h3H,2,5H2,1H3,(H2,6,9)(H,7,8)/t3-,12+/m0/s1
Definition date:2007-02-13
Last modified:2024-09-27
Identifier:O-[(R)-amino(methoxy)phosphoryl]-L-serine
SGX
SGX
Name:O-[(S)-AMINO(METHOXY)PHOSPHORYL]-L-SERINE
Formula:C4 H11 N2 O5 P
SMILES:O=P(OC)(OCC(N)C(=O)O)N
InChi:InChI=1S/C4H11N2O5P/c1-10-12(6,9)11-2-3(5)4(7)8/h3H,2,5H2,1H3,(H2,6,9)(H,7,8)/t3-,12-/m0/s1
Definition date:2007-02-13
Last modified:2024-09-27
Identifier:O-[(S)-amino(methoxy)phosphoryl]-L-serine
SH1
SH1
Name:N-[(2-PHENYLETHYL)SULFONYL]-D-SERYL-N-[(1S)-4-[(DIAMINOMETHYLENE)AMINO]-1-(HYDROXYMETHYL)BUTYL]-L-ALANINAMIDE
Formula:C20 H34 N6 O6 S
SMILES:O=C(NC(CCC/N=C(N)N)CO)C(NC(=O)C(NS(=O)(=O)CCc1ccccc1)CO)C
InChi:InChI=1S/C20H34N6O6S/c1-14(18(29)25-16(12-27)8-5-10-23-20(21)22)24-19(30)17(13-28)26-33(31,32)11-9-15-6-3-2-4-7-15/h2-4,6-7,14,16-17,26-28H,5,8-13H2,1H3,(H,24,30)(H,25,29)(H4,21,22,23)/t14-,16-,17+/m0/s1
Definition date:2004-06-15
Last modified:2024-09-27
Identifier:N-[(2-phenylethyl)sulfonyl]-D-seryl-N-[(1S)-4-[(diaminomethylidene)amino]-1-(hydroxymethyl)butyl]-L-alaninamide
SHW
SHW
Name:S-[2-[3-[[(2S)-2-hydroxy-3,3-dimethyl-4-phosphonooxy-butanoyl]amino]propanoylamino]ethyl] (3R)-3-hydroxyoctanethioate
Formula:C19 H37 N2 O9 P S
SMILES:O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)O)CC(O)CCCCC
InChi:InChI=1S/C19H37N2O9PS/c1-4-5-6-7-14(22)12-16(24)32-11-10-20-15(23)8-9-21-18(26)17(25)19(2,3)13-30-31(27,28)29/h14,17,22,25H,4-13H2,1-3H3,(H,20,23)(H,21,26)(H2,27,28,29)/t14-,17-/m1/s1
Definition date:2009-10-15
Last modified:2024-09-27
Identifier:S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] (3R)-3-hydroxyoctanethioate
SIC
SIC
Name:(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-1-yl]-3-sulfanylpropanoic acid
Formula:C7 H10 N2 O4 S
SMILES:O=C1N(C(=O)CC1N)C(C(=O)O)CS
InChi:InChI=1S/C7H10N2O4S/c8-3-1-5(10)9(6(3)11)4(2-14)7(12)13/h3-4,14H,1-2,8H2,(H,12,13)/t3-,4-/m0/s1
Definition date:2008-06-24
Last modified:2024-09-27
Identifier:(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-1-yl]-3-sulfanylpropanoic acid
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:2024-09-27
Release date:2017-10-11
Identifier:(2~{S})-2-azanyl-3-[4-(dihydroxyboranyl)phenyl]propanoic acid
7NQ
7NQ
Name:~{N}-(4-ethoxyquinazolin-2-yl)propanamide
Formula:C13 H15 N3 O2
SMILES:CCOc1nc(NC(=O)CC)nc2ccccc12
InChi:InChI=1S/C13H15N3O2/c1-3-11(17)15-13-14-10-8-6-5-7-9(10)12(16-13)18-4-2/h5-8H,3-4H2,1-2H3,(H,14,15,16,17)
Definition date:2016-11-28
Last modified:2024-09-27
Release date:2017-11-01
Identifier:~{N}-(4-ethoxyquinazolin-2-yl)propanamide
SJ1
SJ1
Name:N-(ISOBUTOXYCARBONYL)-D-SERYL-N-((1S)-4-{[AMINO(IMINO)METHYL]AMINO}-1-FORMYLBUTYL)-L-ALANINAMIDE
Formula:C17 H32 N6 O6
SMILES:O=C(NC(C(=O)NC(C=O)CCCNC(=[N@H])N)C)C(NC(=O)OCC(C)C)CO
InChi:InChI=1S/C17H32N6O6/c1-10(2)9-29-17(28)23-13(8-25)15(27)21-11(3)14(26)22-12(7-24)5-4-6-20-16(18)19/h7,10-13,25H,4-6,8-9H2,1-3H3,(H,21,27)(H,22,26)(H,23,28)(H4,18,19,20)/t11-,12-,13+/m0/s1
Definition date:2004-06-15
Last modified:2024-09-27
Identifier:N-[(2-methylpropoxy)carbonyl]-D-seryl-N-[(1S)-4-carbamimidamido-1-formylbutyl]-L-alaninamide
7NT
7NT
Name:~{N}-(4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)propanamide
Formula:C13 H16 N4 O2 S
SMILES:CCC(=O)Nc1nc2sccc2c(n1)N3CCOCC3
InChi:InChI=1S/C13H16N4O2S/c1-2-10(18)14-13-15-11(17-4-6-19-7-5-17)9-3-8-20-12(9)16-13/h3,8H,2,4-7H2,1H3,(H,14,15,16,18)
Definition date:2016-11-28
Last modified:2024-09-27
Release date:2017-11-01
Identifier:~{N}-(4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)propanamide
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:2024-09-27
Release date:2020-05-27
Identifier:(2~{S})-2-azanyl-3-(2-sulfanylethanoylamino)propanoic acid
SJF
SJF
Name:(1S,3aR,6aS)-2-[(3,4-dichlorophenoxy)acetyl]-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}octahydrocyclopenta[c]pyrrole-1-carboxamide
Formula:C23 H29 Cl2 N3 O5
SMILES:O=C1NCCC1CC(CO)NC(=O)C1C2CCCC2CN1C(=O)COc1ccc(Cl)c(Cl)c1
InChi:InChI=1S/C23H29Cl2N3O5/c24-18-5-4-16(9-19(18)25)33-12-20(30)28-10-14-2-1-3-17(14)21(28)23(32)27-15(11-29)8-13-6-7-26-22(13)31/h4-5,9,13-15,17,21,29H,1-3,6-8,10-12H2,(H,26,31)(H,27,32)/t13-,14-,15-,17-,21-/m0/s1
Definition date:2023-08-28
Last modified:2024-09-27
Release date:2024-08-28
Identifier:(1S,3aR,6aS)-2-[(3,4-dichlorophenoxy)acetyl]-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}octahydrocyclopenta[c]pyrrole-1-carboxamide
SJW
SJW
Name:3-pyridin-3-ylpropanal
Formula:C8 H9 N O2
SMILES:OC(=O)CCc1cccnc1
InChi:InChI=1S/C8H9NO2/c10-8(11)4-3-7-2-1-5-9-6-7/h1-2,5-6H,3-4H2,(H,10,11)
Definition date:2020-11-20
Last modified:2024-09-27
Release date:2021-12-01
Identifier:3-pyridin-3-ylpropanoic acid
SKN
SKN
Name:((R)-2-(3-ethylphenyl)-1-((S)-3-phenyl-2-(pyrazine-2-carboxamido)propanamido)ethyl)boronic acid
Formula:C24 H27 B N4 O4
SMILES:CCc1cccc(C[CH](NC(=O)[CH](Cc2ccccc2)NC(=O)c3cnccn3)B(O)O)c1
InChi:InChI=1S/C24H27BN4O4/c1-2-17-9-6-10-19(13-17)15-22(25(32)33)29-23(30)20(14-18-7-4-3-5-8-18)28-24(31)21-16-26-11-12-27-21/h3-13,16,20,22,32-33H,2,14-15H2,1H3,(H,28,31)(H,29,30)/t20-,22-/m0/s1
Synonyms:[(1~{R})-2-(3-ethylphenyl)-1-[[(2~{S})-3-phenyl-2-(pyrazin-2-ylcarbonylamino)propanoyl]amino]ethyl]boronic acid
Definition date:2020-11-23
Last modified:2024-09-27
Release date:2021-12-01
Identifier:[(1~{R})-2-(3-ethylphenyl)-1-[[(2~{S})-3-phenyl-2-(pyrazin-2-ylcarbonylamino)propanoyl]amino]ethyl]boronic acid
SLH
SLH
Name:(2S)-3-(1H-imidazol-5-yl)-2-({[(3R,4aS,8aR)-2-(N-phenyl-beta-alanyl)decahydroisoquinolin-3-yl]methyl}amino)propanal
Formula:C25 H35 N5 O2
SMILES:C3C1C(CCCC1)CC(CNC(C=O)Cc2ncnc2)N3C(=O)CCNc4ccccc4
InChi:InChI=1S/C25H35N5O2/c31-17-23(13-22-14-26-18-29-22)28-15-24-12-19-6-4-5-7-20(19)16-30(24)25(32)10-11-27-21-8-2-1-3-9-21/h1-3,8-9,14,17-20,23-24,27-28H,4-7,10-13,15-16H2,(H,26,29)/t19-,20-,23-,24+/m0/s1
Definition date:2015-07-03
Last modified:2024-09-27
Release date:2016-06-22
Identifier:(2S)-3-(1H-imidazol-5-yl)-2-({[(3R,4aS,8aR)-2-(N-phenyl-beta-alanyl)decahydroisoquinolin-3-yl]methyl}amino)propanal
SLL
SLL
Name:(2S)-2-azanyl-6-[(4-hydroxy-4-oxo-butanoyl)amino]hexanoic acid
Formula:C10 H18 N2 O5
SMILES:O=C(O)C(N)CCCCNC(=O)CCC(=O)O
InChi:InChI=1S/C10H18N2O5/c11-7(10(16)17)3-1-2-6-12-8(13)4-5-9(14)15/h7H,1-6,11H2,(H,12,13)(H,14,15)(H,16,17)/t7-/m0/s1
Synonyms:6-N-succinyl-L-lysine
Definition date:2010-03-04
Last modified:2024-09-27
Identifier:N~6~-(3-carboxypropanoyl)-L-lysine
SLZ
SLZ
Name:L-THIALYSINE
Formula:C5 H12 N2 O2 S
SMILES:O=C(O)C(N)CSCCN
InChi:InChI=1S/C5H12N2O2S/c6-1-2-10-3-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:S-(2-aminoethyl)-L-cysteine
SMC
SMC
Name:S-METHYLCYSTEINE
Formula:C4 H9 N O2 S
SMILES:O=C(O)C(N)CSC
InChi:InChI=1S/C4H9NO2S/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:S-methyl-L-cysteine
SMF
SMF
Name:4-SULFOMETHYL-L-PHENYLALANINE
Formula:C10 H13 N O5 S
SMILES:O=S(=O)(O)Cc1ccc(cc1)CC(N)C(=O)O
InChi:InChI=1S/C10H13NO5S/c11-9(10(12)13)5-7-1-3-8(4-2-7)6-17(14,15)16/h1-4,9H,5-6,11H2,(H,12,13)(H,14,15,16)/t9-/m0/s1
Definition date:2003-03-18
Last modified:2024-09-27
Identifier:4-(sulfomethyl)-L-phenylalanine
SNC
SNC
Name:S-NITROSO-CYSTEINE
Formula:C3 H6 N2 O3 S
SMILES:O=C(O)C(N)CSN=O
InChi:InChI=1S/C3H6N2O3S/c4-2(3(6)7)1-9-5-8/h2H,1,4H2,(H,6,7)/t2-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:S-nitroso-L-cysteine
SNK
SNK
Name:(2~{R})-2-azanyl-3-(4-ethanoylsulfanyl-1~{H}-imidazol-5-yl)propanoic acid
Formula:C8 H11 N3 O3 S
SMILES:CC(=O)Sc1nc[nH]c1C[CH](N)C(O)=O
InChi:InChI=1S/C8H11N3O3S/c1-4(12)15-7-6(10-3-11-7)2-5(9)8(13)14/h3,5H,2,9H2,1H3,(H,10,11)(H,13,14)/t5-/m1/s1
Definition date:2020-11-25
Last modified:2024-09-27
Release date:2021-06-16
Identifier:(2~{R})-2-azanyl-3-(4-ethanoylsulfanyl-1~{H}-imidazol-5-yl)propanoic acid
SNM
SNM
Name:N,N-dimethyl-L-serine
Formula:C5 H11 N O3
SMILES:CN(C)[CH](CO)C(O)=O
InChi:InChI=1S/C5H11NO3/c1-6(2)4(3-7)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1
Definition date:2017-12-12
Last modified:2024-09-27
Release date:2018-05-30
Identifier:(2~{S})-2-(dimethylamino)-3-oxidanyl-propanoic acid
SO0
SO0
Name:(1S,3aR,6aS)-2-[(2,4-dichlorophenoxy)acetyl]-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}octahydrocyclopenta[c]pyrrole-1-carboxamide
Formula:C23 H29 Cl2 N3 O5
SMILES:O=C1NCCC1CC(CO)NC(=O)C1C2CCCC2CN1C(=O)COc1ccc(Cl)cc1Cl
InChi:InChI=1S/C23H29Cl2N3O5/c24-15-4-5-19(18(25)9-15)33-12-20(30)28-10-14-2-1-3-17(14)21(28)23(32)27-16(11-29)8-13-6-7-26-22(13)31/h4-5,9,13-14,16-17,21,29H,1-3,6-8,10-12H2,(H,26,31)(H,27,32)/t13-,14-,16-,17-,21-/m0/s1
Definition date:2023-08-28
Last modified:2024-09-27
Release date:2024-08-28
Identifier:(1S,3aR,6aS)-2-[(2,4-dichlorophenoxy)acetyl]-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}octahydrocyclopenta[c]pyrrole-1-carboxamide

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数据于2025-07-09公开中

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