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OMC
OMC
表記:O2'-METHYLYCYTIDINE-5'-MONOPHOSPHATE
組成式:C10 H16 N3 O8 P
SMILES:O=C1N=C(N)C=CN1C2OC(C(O)C2OC)COP(=O)(O)O
InChi:InChI=1S/C10H16N3O8P/c1-19-8-7(14)5(4-20-22(16,17)18)21-9(8)13-3-2-6(11)12-10(13)15/h2-3,5,7-9,14H,4H2,1H3,(H2,11,12,15)(H2,16,17,18)/t5-,7-,8-,9-/m1/s1
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:2'-O-methylcytidine 5'-(dihydrogen phosphate)
ACA
ACA
表記:6-AMINOHEXANOIC ACID
組成式:C6 H13 N O2
SMILES:O=C(O)CCCCCN
InChi:InChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9)
別名:AMINOCAPROIC ACID
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:6-aminohexanoic acid
OMG
OMG
表記:O2'-METHYLGUANOSINE-5'-MONOPHOSPHATE
組成式:C11 H16 N5 O8 P
SMILES:O=C1c2ncn(c2N=C(N)N1)C3OC(C(O)C3OC)COP(=O)(O)O
InChi:InChI=1S/C11H16N5O8P/c1-22-7-6(17)4(2-23-25(19,20)21)24-10(7)16-3-13-5-8(16)14-11(12)15-9(5)18/h3-4,6-7,10,17H,2H2,1H3,(H2,19,20,21)(H3,12,14,15,18)/t4-,6-,7-,10-/m1/s1
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:2'-O-methylguanosine 5'-(dihydrogen phosphate)
OML
OML
表記:(1R,2S,3R,4R)-5-fluoro-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol
組成式:C7 H11 F O5
SMILES:OC1C(CO)=C(F)C(O)C(O)C1O
InChi:InChI=1S/C7H11FO5/c8-3-2(1-9)4(10)6(12)7(13)5(3)11/h4-7,9-13H,1H2/t4-,5+,6+,7+/m1/s1
別名:C5a-fluoro-valienide
定義日:2022-05-12
最終更新日:2024-09-27
公開日:2023-04-05
識別子（ID）:(1R,2S,3R,4R)-5-fluoro-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol
ACN
ACN
表記:ACETONE
組成式:C3 H6 O
SMILES:O=C(C)C
InChi:InChI=1S/C3H6O/c1-3(2)4/h1-2H3
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:propan-2-one
OMU
OMU
表記:O2'-METHYLURIDINE 5'-MONOPHOSPHATE
組成式:C10 H15 N2 O9 P
SMILES:O=C1NC(=O)N(C=C1)C2OC(C(O)C2OC)COP(=O)(O)O
InChi:InChI=1S/C10H15N2O9P/c1-19-8-7(14)5(4-20-22(16,17)18)21-9(8)12-3-2-6(13)11-10(12)15/h2-3,5,7-9,14H,4H2,1H3,(H,11,13,15)(H2,16,17,18)/t5-,7-,8-,9-/m1/s1
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:2'-O-methyluridine 5'-(dihydrogen phosphate)
OMX
OMX
表記:(betaR)-beta-hydroxy-L-Tyrosine
組成式: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+/m0/s1
定義日:2010-08-10
最終更新日:2024-09-27
識別子（ID）:(betaR)-beta-hydroxy-L-tyrosine
OMY
OMY
表記:(betaR)-3-chloro-beta-hydroxy-L-tyrosine
組成式:C9 H10 Cl N O4
SMILES:Clc1cc(ccc1O)C(O)C(C(=O)O)N
InChi:InChI=1S/C9H10ClNO4/c10-5-3-4(1-2-6(5)12)8(13)7(11)9(14)15/h1-3,7-8,12-13H,11H2,(H,14,15)/t7-,8+/m0/s1
定義日:2009-03-27
最終更新日:2024-09-27
識別子（ID）:(betaR)-3-chloro-beta-hydroxy-L-tyrosine
OMZ
OMZ
表記:(betaR)-3-CHLORO-BETA-HYDROXY-D-TYROSINE
組成式:C9 H10 Cl N O4
SMILES:Clc1cc(ccc1O)C(O)C(C(=O)O)N
InChi:InChI=1S/C9H10ClNO4/c10-5-3-4(1-2-6(5)12)8(13)7(11)9(14)15/h1-3,7-8,12-13H,11H2,(H,14,15)/t7-,8-/m1/s1
定義日:2010-08-06
最終更新日:2024-09-27
識別子（ID）:(betaR)-3-chloro-beta-hydroxy-D-tyrosine
ACY
ACY
表記:ACETIC ACID
組成式:C2 H4 O2
SMILES:O=C(O)C
InChi:InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:acetic acid
ONK
ONK
表記:N-hexanoyl-L-valyl-N~1~-[(3S,4S)-3-hydroxy-2,6-dimethylhept-1-en-4-yl]-N~5~,N~5~-dimethyl-L-glutamamide
組成式:C27 H50 N4 O5
SMILES:O=C(NC(CC(C)C)C(O)C(=C)C)C(NC(=O)C(NC(=O)CCCCC)C(C)C)CCC(=O)N(C)C
InChi:InChI=1S/C27H50N4O5/c1-10-11-12-13-22(32)30-24(18(4)5)27(36)28-20(14-15-23(33)31(8)9)26(35)29-21(16-17(2)3)25(34)19(6)7/h17-18,20-21,24-25,34H,6,10-16H2,1-5,7-9H3,(H,28,36)(H,29,35)(H,30,32)/t20-,21-,24-,25-/m0/s1
別名:vinylketone carmaphycin analogue VNK1, single bound form
定義日:2012-11-01
最終更新日:2024-09-27
公開日:2014-01-29
識別子（ID）:N-hexanoyl-L-valyl-N~1~-[(3S,4S)-3-hydroxy-2,6-dimethylhept-1-en-4-yl]-N~5~,N~5~-dimethyl-L-glutamamide
ADM
ADM
表記:ADAMANTANE
組成式:C10 H16
SMILES:C1C2CC3CC1CC(C2)C3
InChi:InChI=1S/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2/t7-,8+,9-,10+
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:tricyclo[3.3.1.1~3,7~]decane
ADT
ADT
表記:3'-DEOXY-3'-ACETAMIDO-THYMIDINE
組成式:C12 H17 N3 O5
SMILES:O=C1NC(=O)N(C=C1C)C2OC(C(NC(=O)C)C2)CO
InChi:InChI=1S/C12H17N3O5/c1-6-4-15(12(19)14-11(6)18)10-3-8(13-7(2)17)9(5-16)20-10/h4,8-10,16H,3,5H2,1-2H3,(H,13,17)(H,14,18,19)/t8-,9+,10+/m0/s1
別名:((((3'-DEOXY-3'-THYMIDINYL)-AMINO)CARBONYL)METHYL)
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:3'-(acetylamino)-3'-deoxythymidine
OO1
OO1
表記:(4-methylphenyl)carbamic acid
組成式:C8 H9 N O2
SMILES:C(O)(=O)Nc1ccc(cc1)C
InChi:InChI=1S/C8H9NO2/c1-6-2-4-7(5-3-6)9-8(10)11/h2-5,9H,1H3,(H,10,11)
定義日:2019-07-01
最終更新日:2024-09-27
公開日:2019-11-06
識別子（ID）:(4-methylphenyl)carbamic acid
OOG
OOG
表記:2-OXOADIPIC ACID
組成式:C6 H8 O5
SMILES:O=C(C(=O)O)CCCC(=O)O
InChi:InChI=1S/C6H8O5/c7-4(6(10)11)2-1-3-5(8)9/h1-3H2,(H,8,9)(H,10,11)
定義日:2015-01-21
最終更新日:2024-09-27
公開日:2015-01-28
識別子（ID）:2-oxohexanedioic acid
OOL
OOL
表記:(E)-1-(4,6-dimethoxypyrimidin-2-yl)methanimine
組成式:C7 H9 N3 O2
SMILES:N=Cc1nc(OC)cc(OC)n1
InChi:InChI=1S/C7H9N3O2/c1-11-6-3-7(12-2)10-5(4-8)9-6/h3-4,8H,1-2H3/b8-4+
定義日:2023-08-17
最終更新日:2024-09-27
公開日:2023-11-08
識別子（ID）:(E)-1-(4,6-dimethoxypyrimidin-2-yl)methanimine
AEM
AEM
表記:2-AMINOETHANIMIDIC ACID
組成式:C2 H6 N2
SMILES:[N@H]=CCN
InChi:InChI=1S/C2H6N2/c3-1-2-4/h1,3H,2,4H2/b3-1+
定義日:2001-09-25
最終更新日:2024-09-27
識別子（ID）:(2E)-2-iminoethanamine
AEQ
AEQ
表記:methyl 1-propanoyl-3,4-dihydro-2~{H}-quinoline-6-carboxylate
組成式:C14 H17 N O3
SMILES:CCC(=O)N1CCCc2cc(ccc12)C(=O)OC
InChi:InChI=1S/C14H17NO3/c1-3-13(16)15-8-4-5-10-9-11(14(17)18-2)6-7-12(10)15/h6-7,9H,3-5,8H2,1-2H3
定義日:2017-08-18
最終更新日:2024-09-27
公開日:2018-03-14
識別子（ID）:methyl 1-propanoyl-3,4-dihydro-2~{H}-quinoline-6-carboxylate
OP0
OP0
表記:(2S,5R)-N-(2-aminoethoxy)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide
組成式:C9 H18 N4 O7 S
SMILES:O=CN1C(C(=O)NOCCN)CCC(NOS(=O)(=O)O)C1
InChi:InChI=1S/C9H18N4O7S/c10-3-4-19-12-9(15)8-2-1-7(5-13(8)6-14)11-20-21(16,17)18/h6-8,11H,1-5,10H2,(H,12,15)(H,16,17,18)/t7-,8+/m1/s1
定義日:2014-12-09
最終更新日:2024-09-27
公開日:2015-07-01
識別子（ID）:(2S,5R)-N-(2-aminoethoxy)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide
AES
AES
表記:4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE
組成式:C8 H10 F N O2 S
SMILES:O=S(F)(=O)c1ccc(cc1)CCN
InChi:InChI=1S/C8H10FNO2S/c9-13(11,12)8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2
別名:AEBSF
定義日:2005-09-27
最終更新日:2024-09-27
識別子（ID）:4-(2-aminoethyl)benzenesulfonyl fluoride
OPE
OPE
表記:PHOSPHORIC ACID MONO-(2-AMINO-ETHYL) ESTER
組成式:C2 H8 N O4 P
SMILES:O=P(O)(O)OCCN
InChi:InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6)
別名:COLAMINE PHOSPHORIC ACID
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:2-aminoethyl dihydrogen phosphate
OPP
OPP
表記:1-[PYRROL-1-YL-2,5-DIONE-METHOXYMETHYL]-PYRROLE-2,5-DIONE
組成式:C10 H8 N2 O5
SMILES:O=C1N(C(=O)C=C1)COCN2C(=O)C=CC2=O
InChi:InChI=1S/C10H8N2O5/c13-7-1-2-8(14)11(7)5-17-6-12-9(15)3-4-10(12)16/h1-4H,5-6H2
定義日:2001-09-06
最終更新日:2024-09-27
識別子（ID）:1,1'-(oxydimethanediyl)bis(1H-pyrrole-2,5-dione)
OQ2
OQ2
表記:~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{R})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide
組成式:C33 H40 F3 N7 O3
SMILES:CCN1CCN(CC1)Cc2ccc(NC(=O)c3ccc(C)c(Oc4ccnc(N[CH]5CCN(C5)C(=O)CC)n4)c3)cc2C(F)(F)F
InChi:InChI=1S/C33H40F3N7O3/c1-4-30(44)43-13-11-26(21-43)39-32-37-12-10-29(40-32)46-28-18-23(7-6-22(28)3)31(45)38-25-9-8-24(27(19-25)33(34,35)36)20-42-16-14-41(5-2)15-17-42/h6-10,12,18-19,26H,4-5,11,13-17,20-21H2,1-3H3,(H,38,45)(H,37,39,40)/t26-/m1/s1
定義日:2020-03-27
最終更新日:2024-09-27
公開日:2020-08-12
識別子（ID）:~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{R})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide
OQ8
OQ8
表記:~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{S})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide
組成式:C33 H40 F3 N7 O3
SMILES:CCN1CCN(CC1)Cc2ccc(NC(=O)c3ccc(C)c(Oc4ccnc(N[CH]5CCN(C5)C(=O)CC)n4)c3)cc2C(F)(F)F
InChi:InChI=1S/C33H40F3N7O3/c1-4-30(44)43-13-11-26(21-43)39-32-37-12-10-29(40-32)46-28-18-23(7-6-22(28)3)31(45)38-25-9-8-24(27(19-25)33(34,35)36)20-42-16-14-41(5-2)15-17-42/h6-10,12,18-19,26H,4-5,11,13-17,20-21H2,1-3H3,(H,38,45)(H,37,39,40)/t26-/m0/s1
定義日:2020-03-27
最終更新日:2024-09-27
公開日:2020-08-12
識別子（ID）:~{N}-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-[2-[[(3~{S})-1-propanoylpyrrolidin-3-yl]amino]pyrimidin-4-yl]oxy-benzamide
OQB
OQB
表記:4-OXO-3-[(6-{[4-(QUINOXALIN-2-YLAMINO)-BENZOYLAMINO]-METHYL}-PYRIDINE-3-CARBONYL)-AMINO]-BUTYRIC ACID
組成式:C26 H22 N6 O5
SMILES:O=C(O)CC(C=O)NC(=O)c1cnc(cc1)CNC(=O)c4ccc(Nc2nc3c(nc2)cccc3)cc4
InChi:InChI=1S/C26H22N6O5/c33-15-20(11-24(34)35)31-26(37)17-7-10-19(27-12-17)13-29-25(36)16-5-8-18(9-6-16)30-23-14-28-21-3-1-2-4-22(21)32-23/h1-10,12,14-15,20H,11,13H2,(H,29,36)(H,30,32)(H,31,37)(H,34,35)/t20-/m0/s1
定義日:2004-01-09
最終更新日:2024-09-27
識別子（ID）:(3S)-4-oxo-3-[({6-[({[4-(quinoxalin-2-ylamino)phenyl]carbonyl}amino)methyl]pyridin-3-yl}carbonyl)amino]butanoic acid

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