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GF8
GF8
表記:2-(3,4-dichlorophenyl)-~{N}-(2-sulfanylethyl)ethanamide
組成式:C10 H11 Cl2 N O S
SMILES:SCCNC(=O)Cc1ccc(Cl)c(Cl)c1
InChi:InChI=1S/C10H11Cl2NOS/c11-8-2-1-7(5-9(8)12)6-10(14)13-3-4-15/h1-2,5,15H,3-4,6H2,(H,13,14)
定義日:2018-09-14
最終更新日:2024-09-27
公開日:2019-02-27
識別子（ID）:2-(3,4-dichlorophenyl)-~{N}-(2-sulfanylethyl)ethanamide
TTQ
TTQ
表記:6-AMINO-7-HYDROXY-L-TRYPTOPHAN
組成式:C11 H13 N3 O3
SMILES:O=C(O)C(N)Cc2c1ccc(c(O)c1nc2)N
InChi:InChI=1S/C11H13N3O3/c12-7-2-1-6-5(3-8(13)11(16)17)4-14-9(6)10(7)15/h1-2,4,8,14-15H,3,12-13H2,(H,16,17)/t8-/m0/s1
定義日:2006-08-21
最終更新日:2024-09-27
識別子（ID）:6-amino-7-hydroxy-L-tryptophan
TTS
TTS
表記:3-((3E)-4-HYDROXY-3-{[2-(4-HYDROXYPHENYL)ETHYL]IMINO}-6-OXOCYCLOHEXA-1,4-DIEN-1-YL)ALANINE
組成式:C17 H18 N2 O5
SMILES:O=C2C=C(O)/C(=N/CCc1ccc(O)cc1)C=C2CC(C(=O)O)N
InChi:InChI=1S/C17H18N2O5/c18-13(17(23)24)7-11-8-14(16(22)9-15(11)21)19-6-5-10-1-3-12(20)4-2-10/h1-4,8-9,13,20,22H,5-7,18H2,(H,23,24)/b19-14+/t13-/m0/s1
定義日:2005-09-06
最終更新日:2024-09-27
識別子（ID）:3-[(3E)-4-hydroxy-3-{[2-(4-hydroxyphenyl)ethyl]imino}-6-oxocyclohexa-1,4-dien-1-yl]-L-alanine
GFT
GFT
表記:(2S)-2-azanyl-3-[cyclohexyloxy(methyl)phosphoryl]oxy-propanoic acid
組成式:C10 H20 N O5 P
SMILES:O=C(O)C(N)COP(=O)(OC1CCCCC1)C
InChi:InChI=1S/C10H20NO5P/c1-17(14,15-7-9(11)10(12)13)16-8-5-3-2-4-6-8/h8-9H,2-7,11H2,1H3,(H,12,13)/t9-,17-/m0/s1
別名:Cyclosarin bound Serine
定義日:2013-02-04
最終更新日:2024-09-27
公開日:2013-03-27
識別子（ID）:O-[(S)-(cyclohexyloxy)(methyl)phosphoryl]-L-serine
GFX
GFX
表記:methyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate, radical
組成式:C10 H16 F N O3
SMILES:FC1=C(C(=O)OC)C(C)(C)N(O)C1(C)C
InChi:InChI=1S/C10H16FNO3/c1-9(2)6(8(13)15-5)7(11)10(3,4)12(9)14/h14H,1-5H3
定義日:2023-07-20
最終更新日:2024-09-27
公開日:2024-06-05
識別子（ID）:methyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate
GG6
GG6
表記:[(1S,2S)-1,2-DIHYDROXYPROPYL]PHOSPHONIC ACID
組成式:C3 H9 O5 P
SMILES:O=P(O)(O)C(O)C(O)C
InChi:InChI=1S/C3H9O5P/c1-2(4)3(5)9(6,7)8/h2-5H,1H3,(H2,6,7,8)/t2-,3-/m0/s1
定義日:2007-03-21
最終更新日:2024-09-27
識別子（ID）:[(1S,2S)-1,2-dihydroxypropyl]phosphonic acid
GG7
GG7
表記:[(1R)-1-AMINOETHYL]PHOSPHONIC ACID
組成式:C2 H8 N O3 P
SMILES:O=P(O)(O)C(N)C
InChi:InChI=1S/C2H8NO3P/c1-2(3)7(4,5)6/h2H,3H2,1H3,(H2,4,5,6)/t2-/m1/s1
定義日:2007-04-13
最終更新日:2024-09-27
識別子（ID）:[(1R)-1-aminoethyl]phosphonic acid
GGB
GGB
表記:L-CANAVANINE
組成式:C5 H12 N4 O3
SMILES:O=C(O)C(N)CCONC(=[N@H])N
InChi:InChI=1S/C5H12N4O3/c6-3(4(10)11)1-2-12-9-5(7)8/h3H,1-2,6H2,(H,10,11)(H4,7,8,9)/t3-/m0/s1
別名:L-2-AMINO-4-(GUANIDINOOXY)BUTYRIC ACID
定義日:1999-07-27
最終更新日:2024-09-27
識別子（ID）:O-carbamimidamido-L-homoserine
TUK
TUK
表記:2-[2-[(1~{S})-1-azanyl-3-methylsulfanyl-propyl]-4-(1~{H}-indol-3-ylmethyl)-5-oxidanylidene-2~{H}-imidazol-1-yl]ethanal
組成式:C18 H22 N4 O3 S
SMILES:CSCC[CH](N)[CH]1N=C(Cc2c[nH]c3ccccc23)C(=O)N1CC(O)=O
InChi:InChI=1S/C18H22N4O3S/c1-26-7-6-13(19)17-21-15(18(25)22(17)10-16(23)24)8-11-9-20-14-5-3-2-4-12(11)14/h2-5,9,13,17,20H,6-8,10,19H2,1H3,(H,23,24)/t13-,17-/m0/s1
定義日:2021-01-13
最終更新日:2024-09-27
公開日:2022-03-02
識別子（ID）:2-[2-[(1~{S})-1-azanyl-3-methylsulfanyl-propyl]-4-(1~{H}-indol-3-ylmethyl)-5-oxidanylidene-2~{H}-imidazol-1-yl]ethanoic acid
GGL
GGL
表記:GAMMA-L-GLUTAMIC ACID
組成式:C5 H9 N O4
SMILES:O=C(O)C(N)CCC(=O)O
InChi:InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
別名:L-GLUTAMIC ACID
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:L-glutamic acid
TVA
TVA
表記:N-[(2R,3S)-3-amino-2-hydroxy-4-(thiophen-2-yl)butyl]-L-norvaline
組成式:C13 H22 N2 O3 S
SMILES:O=C(O)C(NCC(O)C(N)Cc1sccc1)CCC
InChi:InChI=1S/C13H22N2O3S/c1-2-4-11(13(17)18)15-8-12(16)10(14)7-9-5-3-6-19-9/h3,5-6,10-12,15-16H,2,4,7-8,14H2,1H3,(H,17,18)/t10-,11-,12+/m0/s1
定義日:2014-06-24
最終更新日:2024-09-27
公開日:2015-07-01
識別子（ID）:N-[(2R,3S)-3-amino-2-hydroxy-4-(thiophen-2-yl)butyl]-L-norvaline
GH4
GH4
表記:4-[1,3-benzodioxol-5-ylmethyl(2-phenoxyethyl)amino]-5-fluoropyrimidine-2-carbonitrile
組成式:C21 H19 F N4 O3
SMILES:Fc1cnc(C=N)nc1N(CCOc2ccccc2)Cc3ccc4OCOc4c3
InChi:InChI=1S/C21H19FN4O3/c22-17-12-24-20(11-23)25-21(17)26(8-9-27-16-4-2-1-3-5-16)13-15-6-7-18-19(10-15)29-14-28-18/h1-7,10-12,23H,8-9,13-14H2/b23-11+
定義日:2016-12-21
最終更新日:2024-09-27
公開日:2017-03-22
識別子（ID）:~{N}-(1,3-benzodioxol-5-ylmethyl)-5-fluoranyl-2-(iminomethyl)-~{N}-(2-phenoxyethyl)pyrimidin-4-amine
TVB
TVB
表記:4-[[(2~{R})-2-methyl-3,4-dihydro-2~{H}-quinolin-1-yl]sulfonyl]benzaldehyde
組成式:C17 H17 N O3 S
SMILES:C[CH]1CCc2ccccc2N1[S](=O)(=O)c3ccc(C=O)cc3
InChi:InChI=1S/C17H17NO3S/c1-13-6-9-15-4-2-3-5-17(15)18(13)22(20,21)16-10-7-14(12-19)8-11-16/h2-5,7-8,10-13H,6,9H2,1H3/t13-/m1/s1
定義日:2021-01-13
最終更新日:2024-09-27
公開日:2021-06-16
識別子（ID）:4-[[(2~{R})-2-methyl-3,4-dihydro-2~{H}-quinolin-1-yl]sulfonyl]benzaldehyde
TVE
TVE
表記:(2~{S},3~{R},4~{R})-3-[5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-4-methyl-5-[(2~{S},3~{R})-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3,4-dihydro-2~{H}-pyrrole-2-carboxylic acid
組成式:C22 H27 N3 O7 S
SMILES:C[CH](O)[CH](C=O)C1=N[CH]([CH](SC2CNC(C2)C(=O)Nc3cccc(c3)C(O)=O)[CH]1C)C(O)=O
InChi:InChI=1S/C22H27N3O7S/c1-10-17(15(9-26)11(2)27)25-18(22(31)32)19(10)33-14-7-16(23-8-14)20(28)24-13-5-3-4-12(6-13)21(29)30/h3-6,9-11,14-16,18-19,23,27H,7-8H2,1-2H3,(H,24,28)(H,29,30)(H,31,32)/t10-,11-,14?,15-,16?,18-,19-/m1/s1
定義日:2021-01-13
最終更新日:2024-09-27
公開日:2021-07-21
識別子（ID）:(2~{S},3~{R},4~{R})-3-[(5~{S})-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-4-methyl-5-[(2~{S},3~{R})-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3,4-dihydro-2~{H}-pyrrole-2-carboxylic acid
GHG
GHG
表記:(2S,4S)-2,5-diamino-4-hydroxy-5-oxopentanoic acid (non-preferred name)
組成式:C5 H10 N2 O4
SMILES:O=C(N)C(O)CC(C(=O)O)N
InChi:InChI=1S/C5H10N2O4/c6-2(5(10)11)1-3(8)4(7)9/h2-3,8H,1,6H2,(H2,7,9)(H,10,11)/t2-,3-/m0/s1
定義日:2004-01-20
最終更新日:2024-09-27
識別子（ID）:(2S,4S)-2,5-diamino-4-hydroxy-5-oxopentanoic acid (non-preferred name)
GHP
GHP
表記:(2R)-amino(4-hydroxyphenyl)ethanoic acid
組成式:C8 H9 N O3
SMILES:O=C(O)C(N)c1ccc(O)cc1
InChi:InChI=1S/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m1/s1
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:(2R)-amino(4-hydroxyphenyl)ethanoic acid
GHS
GHS
表記:6-carbamimidamidohexanoic acid
組成式:C7 H15 N3 O2
SMILES:O=C(O)CCCCCNC(=[N@H])N
InChi:InChI=1S/C7H15N3O2/c8-7(9)10-5-3-1-2-4-6(11)12/h1-5H2,(H,11,12)(H4,8,9,10)
定義日:2012-03-06
最終更新日:2024-09-27
識別子（ID）:6-carbamimidamidohexanoic acid
GHV
GHV
表記:(2S)-2-[[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]amino]-N-[(2S)-1-oxidanyl-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]-3-phenyl-propanamide
組成式:C27 H34 N4 O4
SMILES:CN(C)c1ccc(C=CC(=O)N[CH](Cc2ccccc2)C(=O)N[CH](CO)C[CH]3CCNC3=O)cc1
InChi:InChI=1S/C27H34N4O4/c1-31(2)23-11-8-19(9-12-23)10-13-25(33)30-24(16-20-6-4-3-5-7-20)27(35)29-22(18-32)17-21-14-15-28-26(21)34/h3-13,21-22,24,32H,14-18H2,1-2H3,(H,28,34)(H,29,35)(H,30,33)/b13-10+/t21-,22-,24-/m0/s1
定義日:2012-08-13
最終更新日:2024-09-27
公開日:2016-06-01
識別子（ID）:(2~{S})-2-[[(~{E})-3-[4-(dimethylamino)phenyl]prop-2-enoyl]amino]-~{N}-[(2~{S})-1-oxidanyl-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]-3-phenyl-propanamide
GHX
GHX
表記:(phenylmethyl) N-[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanyl-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate
組成式:C24 H29 N3 O5
SMILES:OC[CH](C[CH]1CCNC1=O)NC(=O)[CH](Cc2ccccc2)NC(=O)OCc3ccccc3
InChi:InChI=1S/C24H29N3O5/c28-15-20(14-19-11-12-25-22(19)29)26-23(30)21(13-17-7-3-1-4-8-17)27-24(31)32-16-18-9-5-2-6-10-18/h1-10,19-21,28H,11-16H2,(H,25,29)(H,26,30)(H,27,31)/t19-,20-,21-/m0/s1
定義日:2012-08-13
最終更新日:2024-09-27
公開日:2016-06-01
識別子（ID）:(phenylmethyl) ~{N}-[(2~{S})-1-oxidanylidene-1-[[(2~{S})-1-oxidanyl-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate
GHY
GHY
表記:propan-2-yl N-[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanyl-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate
組成式:C20 H29 N3 O5
SMILES:CC(C)OC(=O)N[CH](Cc1ccccc1)C(=O)N[CH](CO)C[CH]2CCNC2=O
InChi:InChI=1S/C20H29N3O5/c1-13(2)28-20(27)23-17(10-14-6-4-3-5-7-14)19(26)22-16(12-24)11-15-8-9-21-18(15)25/h3-7,13,15-17,24H,8-12H2,1-2H3,(H,21,25)(H,22,26)(H,23,27)/t15-,16-,17-/m0/s1
定義日:2012-08-15
最終更新日:2024-09-27
公開日:2016-06-01
識別子（ID）:propan-2-yl ~{N}-[(2~{S})-1-oxidanylidene-1-[[(2~{S})-1-oxidanyl-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate
GHZ
GHZ
表記:2-methylpropyl N-[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanyl-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate
組成式:C21 H31 N3 O5
SMILES:CC(C)COC(=O)N[CH](Cc1ccccc1)C(=O)N[CH](CO)C[CH]2CCNC2=O
InChi:InChI=1S/C21H31N3O5/c1-14(2)13-29-21(28)24-18(10-15-6-4-3-5-7-15)20(27)23-17(12-25)11-16-8-9-22-19(16)26/h3-7,14,16-18,25H,8-13H2,1-2H3,(H,22,26)(H,23,27)(H,24,28)/t16-,17-,18-/m0/s1
定義日:2012-08-15
最終更新日:2024-09-27
公開日:2016-06-01
識別子（ID）:2-methylpropyl ~{N}-[(2~{S})-1-oxidanylidene-1-[[(2~{S})-1-oxidanyl-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-3-phenyl-propan-2-yl]carbamate
TW8
TW8
表記:4-(3,4-dihydro-2~{H}-quinoxalin-1-ylsulfonyl)benzaldehyde
組成式:C15 H14 N2 O3 S
SMILES:O=Cc1ccc(cc1)[S](=O)(=O)N2CCNc3ccccc23
InChi:InChI=1S/C15H14N2O3S/c18-11-12-5-7-13(8-6-12)21(19,20)17-10-9-16-14-3-1-2-4-15(14)17/h1-8,11,16H,9-10H2
定義日:2021-01-14
最終更新日:2024-09-27
公開日:2021-09-15
識別子（ID）:4-(3,4-dihydro-2~{H}-quinoxalin-1-ylsulfonyl)benzaldehyde
TWE
TWE
表記:1-(4-methanoylphenyl)carbonylpiperidine-4-carbonitrile
組成式:C14 H14 N2 O2
SMILES:O=Cc1ccc(cc1)C(=O)N2CCC(CC2)C#N
InChi:InChI=1S/C14H14N2O2/c15-9-11-5-7-16(8-6-11)14(18)13-3-1-12(10-17)2-4-13/h1-4,10-11H,5-8H2
定義日:2021-01-14
最終更新日:2024-09-27
公開日:2021-06-16
識別子（ID）:1-(4-methanoylphenyl)carbonylpiperidine-4-carbonitrile
GIC
GIC
表記:N-(2-aminoethyl)-N-(1H-indol-3-ylacetyl)glycine
組成式:C14 H17 N3 O3
SMILES:O=C(O)CN(C(=O)Cc2c1ccccc1nc2)CCN
InChi:InChI=1S/C14H17N3O3/c15-5-6-17(9-14(19)20)13(18)7-10-8-16-12-4-2-1-3-11(10)12/h1-4,8,16H,5-7,9,15H2,(H,19,20)
定義日:2010-10-14
最終更新日:2024-09-27
識別子（ID）:N-(2-aminoethyl)-N-(1H-indol-3-ylacetyl)glycine
TWQ
TWQ
表記:3-[(3~{S})-3-methoxypiperidin-1-yl]-4-nitro-benzaldehyde
組成式:C13 H16 N2 O4
SMILES:CO[CH]1CCCN(C1)c2cc(C=O)ccc2[N](=O)=O
InChi:InChI=1S/C13H16N2O4/c1-19-11-3-2-6-14(8-11)13-7-10(9-16)4-5-12(13)15(17)18/h4-5,7,9,11H,2-3,6,8H2,1H3/t11-/m0/s1
定義日:2021-01-14
最終更新日:2024-09-27
公開日:2021-06-09
識別子（ID）:3-[(3~{S})-3-methoxypiperidin-1-yl]-4-nitro-benzaldehyde

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