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SQM
SQM
表記:4-benzamido-2-methyl-pyrazole-3-carboxamide
組成式:C12 H12 N4 O2
SMILES:Cn1ncc(NC(=O)c2ccccc2)c1C(N)=O
InChi:InChI=1S/C12H12N4O2/c1-16-10(11(13)17)9(7-14-16)15-12(18)8-5-3-2-4-6-8/h2-7H,1H3,(H2,13,17)(H,15,18)
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:4-benzamido-2-methyl-pyrazole-3-carboxamide
SQP
SQP
表記:2-(4-aminophenyl)benzoic acid
組成式:C13 H11 N O2
SMILES:Nc1ccc(cc1)c2ccccc2C(O)=O
InChi:InChI=1S/C13H11NO2/c14-10-7-5-9(6-8-10)11-3-1-2-4-12(11)13(15)16/h1-8H,14H2,(H,15,16)
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:2-(4-aminophenyl)benzoic acid
BEM
BEM
表記:beta-D-mannopyranuronic acid
組成式:C6 H10 O7
SMILES:O=C(O)C1OC(O)C(O)C(O)C1O
InChi:InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2-,3-,4-,6+/m0/s1
別名:beta-D-mannuronic acid
定義日:2007-11-05
最終更新日:2020-07-17
識別子（ID）:beta-D-mannopyranuronic acid
SQV
SQV
表記:methyl (2~{S})-2-(4-methoxypyridin-2-yl)propanoate
組成式:C10 H13 N O3
SMILES:COC(=O)[CH](C)c1cc(OC)ccn1
InChi:InChI=1S/C10H13NO3/c1-7(10(12)14-3)9-6-8(13-2)4-5-11-9/h4-7H,1-3H3/t7-/m0/s1
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:methyl (2~{S})-2-(4-methoxypyridin-2-yl)propanoate
SQY
SQY
表記:methyl (2~{R})-3-(4-bromophenyl)-2-pyridin-4-yl-propanoate
組成式:C15 H14 Br N O2
SMILES:COC(=O)[CH](Cc1ccc(Br)cc1)c2ccncc2
InChi:InChI=1S/C15H14BrNO2/c1-19-15(18)14(12-6-8-17-9-7-12)10-11-2-4-13(16)5-3-11/h2-9,14H,10H2,1H3/t14-/m1/s1
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:methyl (2~{R})-3-(4-bromophenyl)-2-pyridin-4-yl-propanoate
SR1
SR1
表記:5-S-methyl-5-thio-alpha-D-ribofuranose
組成式:C6 H12 O4 S
SMILES:OC1C(OC(O)C1O)CSC
InChi:InChI=1S/C6H12O4S/c1-11-2-3-4(7)5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6+/m1/s1
別名:5-S-methyl-5-thio-alpha-D-ribose
定義日:2005-03-31
最終更新日:2020-07-17
識別子（ID）:5-S-methyl-5-thio-alpha-D-ribofuranose
SR4
SR4
表記:2,3-dihydro-1-benzoxepine-5-carboxylic acid
組成式:C11 H10 O3
SMILES:OC(=O)C1=CCCOc2ccccc12
InChi:InChI=1S/C11H10O3/c12-11(13)9-5-3-7-14-10-6-2-1-4-8(9)10/h1-2,4-6H,3,7H2,(H,12,13)
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:2,3-dihydro-1-benzoxepine-5-carboxylic acid
SRJ
SRJ
表記:(3~{S})-2-(cyclopropylmethyl)-3-[(~{S})-oxidanyl(phenyl)methyl]-2-azabicyclo[2.2.2]octan-4-ol
組成式:C18 H25 N O2
SMILES:O[CH]([CH]1N(CC2CC2)C3CCC1(O)CC3)c4ccccc4
InChi:InChI=1S/C18H25NO2/c20-16(14-4-2-1-3-5-14)17-18(21)10-8-15(9-11-18)19(17)12-13-6-7-13/h1-5,13,15-17,20-21H,6-12H2/t15-,16-,17-,18-/m0/s1
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:(3~{S})-2-(cyclopropylmethyl)-3-[(~{S})-oxidanyl(phenyl)methyl]-2-azabicyclo[2.2.2]octan-4-ol
BFN
BFN
表記:5-acetamido-9-(benzoylamino)-3,5,9-trideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
組成式:C18 H23 F N2 O9
SMILES:O=C(c1ccccc1)NCC(O)C(O)C2OC(O)(C(=O)O)C(F)C(O)C2NC(=O)C
InChi:InChI=1S/C18H23FN2O9/c1-8(22)21-11-13(25)15(19)18(29,17(27)28)30-14(11)12(24)10(23)7-20-16(26)9-5-3-2-4-6-9/h2-6,10-15,23-25,29H,7H2,1H3,(H,20,26)(H,21,22)(H,27,28)/t10-,11-,12-,13-,14-,15-,18+/m1/s1
別名:5-(acetylamino)-9-(benzoylamino)-3,5,9-trideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
定義日:2007-11-07
最終更新日:2020-07-17
識別子（ID）:5-(acetylamino)-9-(benzoylamino)-3,5,9-trideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
BG6
BG6
表記:6-O-phosphono-beta-D-glucopyranose
組成式:C6 H13 O9 P
SMILES:O=P(O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1
別名:BETA-D-GLUCOSE-6-PHOSPHATE
定義日:2000-08-29
最終更新日:2020-07-17
識別子（ID）:6-O-phosphono-beta-D-glucopyranose
BG8
BG8
表記:2-(benzoylamino)-2-deoxy-beta-D-glucopyranose
組成式:C13 H17 N O6
SMILES:C2(C(NC(c1ccccc1)=O)C(OC(C2O)CO)O)O
InChi:InChI=1S/C13H17NO6/c15-6-8-10(16)11(17)9(13(19)20-8)14-12(18)7-4-2-1-3-5-7/h1-5,8-11,13,15-17,19H,6H2,(H,14,18)/t8-,9-,10-,11-,13-/m1/s1
別名:N-benzoyl-beta-D-glucosamine
定義日:2015-06-02
最終更新日:2020-07-17
公開日:2015-06-17
識別子（ID）:2-(benzoylamino)-2-deoxy-beta-D-glucopyranose
BGC
BGC
表記:beta-D-glucopyranose
組成式:C6 H12 O6
SMILES:OC1C(O)C(OC(O)C1O)CO
InChi:InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1
別名:beta-D-glucose
定義日:2002-01-22
最終更新日:2020-07-17
識別子（ID）:beta-D-glucopyranose
SSG
SSG
表記:1,4-dithio-beta-D-glucopyranose
組成式:C6 H12 O4 S2
SMILES:OC1C(S)C(OC(S)C1O)CO
InChi:InChI=1S/C6H12O4S2/c7-1-2-5(11)3(8)4(9)6(12)10-2/h2-9,11-12H,1H2/t2-,3-,4-,5-,6+/m1/s1
別名:1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE
定義日:2000-07-13
最終更新日:2020-07-17
識別子（ID）:1,4-dithio-beta-D-glucopyranose
BGL
BGL
表記:2-O-octyl-beta-D-glucopyranose
組成式:C14 H28 O6
SMILES:O(CCCCCCCC)C1C(O)C(O)C(OC1O)CO
InChi:InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-13-12(17)11(16)10(9-15)20-14(13)18/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14-/m1/s1
別名:2-O-octyl-beta-D-glucose
定義日:1999-07-08
最終更新日:2020-07-17
識別子（ID）:2-O-octyl-beta-D-glucopyranose
BGN
BGN
表記:2-(butanoylamino)-2-deoxy-beta-D-glucopyranose
組成式:C10 H19 N O6
SMILES:O=C(NC1C(O)C(O)C(OC1O)CO)CCC
InChi:InChI=1S/C10H19NO6/c1-2-3-6(13)11-7-9(15)8(14)5(4-12)17-10(7)16/h5,7-10,12,14-16H,2-4H2,1H3,(H,11,13)/t5-,7-,8-,9-,10-/m1/s1
別名:N-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDE
定義日:2001-07-31
最終更新日:2020-07-17
識別子（ID）:2-(butanoylamino)-2-deoxy-beta-D-glucopyranose
BGP
BGP
表記:6-O-phosphono-beta-D-galactopyranose
組成式:C6 H13 O9 P
SMILES:O=P(O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3+,4+,5-,6-/m1/s1
別名:BETA-GALACTOSE-6-PHOSPHATE
定義日:1999-07-08
最終更新日:2020-07-17
識別子（ID）:6-O-phosphono-beta-D-galactopyranose
BGS
BGS
表記:(1S)-1,5-anhydro-1-(ethylsulfonyl)-D-glucitol
組成式:C8 H16 O7 S
SMILES:O=S(=O)(C1OC(C(O)C(O)C1O)CO)CC
InChi:InChI=1S/C8H16O7S/c1-2-16(13,14)8-7(12)6(11)5(10)4(3-9)15-8/h4-12H,2-3H2,1H3/t4-,5-,6+,7-,8+/m1/s1
別名:BETA-D-GLUCOPYRANOSYLSULFONYLETHANE
定義日:2005-10-26
最終更新日:2020-07-17
識別子（ID）:(1S)-1,5-anhydro-1-(ethylsulfonyl)-D-glucitol
SSY
SSY
表記:~{N}-(3-ethanoylphenyl)-2,2,2-tris(fluoranyl)ethanamide
組成式:C10 H8 F3 N O2
SMILES:CC(=O)c1cccc(NC(=O)C(F)(F)F)c1
InChi:InChI=1S/C10H8F3NO2/c1-6(15)7-3-2-4-8(5-7)14-9(16)10(11,12)13/h2-5H,1H3,(H,14,16)
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:~{N}-(3-ethanoylphenyl)-2,2,2-tris(fluoranyl)ethanamide
BHG
BHG
表記:hexyl beta-D-galactopyranoside
組成式:C12 H24 O6
SMILES:O(CCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C12H24O6/c1-2-3-4-5-6-17-12-11(16)10(15)9(14)8(7-13)18-12/h8-16H,2-7H2,1H3/t8-,9+,10+,11-,12-/m1/s1
別名:2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-3,4,5-TRIOL
定義日:2000-10-11
最終更新日:2020-07-17
識別子（ID）:hexyl beta-D-galactopyranoside
STW
STW
表記:Stachyose
組成式:C24 H42 O21
SMILES:OC[CH]1O[CH](OC[CH]2O[CH](OC[CH]3O[CH](O[C]4(CO)O[CH](CO)[CH](O)[CH]4O)[CH](O)[CH](O)[CH]3O)[CH](O)[CH](O)[CH]2O)[CH](O)[CH](O)[CH]1O
InChi:InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7-,8-,9-,10+,11+,12-,13-,14+,15-,16+,17-,18+,19-,20-,21+,22+,23-,24+/m1/s1
定義日:2017-10-12
最終更新日:2020-07-17
公開日:2018-04-11
識別子（ID）:(2~{S},3~{R},4~{S},5~{R},6~{R})-2-[[(2~{R},3~{R},4~{R},5~{S},6~{S})-6-[[(2~{R},3~{S},4~{S},5~{R},6~{R})-6-[(2~{S},3~{R},4~{S},5~{R})-2,5-bis(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-3,4,5-tris(oxidanyl)oxan-2-yl]methoxy]-3,4,5-tris(oxidanyl)oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
STZ
STZ
表記:Streptozotocin
組成式:C8 H15 N3 O7
SMILES:O=NN(C(=O)NC1C(O)C(O)C(OC1O)CO)C
InChi:InChI=1S/C8H15N3O7/c1-11(10-17)8(16)9-4-6(14)5(13)3(2-12)18-7(4)15/h3-7,12-15H,2H2,1H3,(H,9,16)/t3-,4-,5-,6-,7-/m1/s1
別名:2-deoxy-2-{[methyl(nitroso)carbamoyl]amino}-beta-D-glucopyranose
定義日:2008-12-02
最終更新日:2020-07-17
識別子（ID）:2-deoxy-2-{[methyl(nitroso)carbamoyl]amino}-beta-D-glucopyranose
SU7
SU7
表記:3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propanenitrile
組成式:C15 H18 N2 O
SMILES:O=C(CC#N)N1CCC(CC1)Cc2ccccc2
InChi:InChI=1S/C15H18N2O/c16-9-6-15(18)17-10-7-14(8-11-17)12-13-4-2-1-3-5-13/h1-5,14H,6-8,10-12H2
定義日:2020-03-11
最終更新日:2020-07-17
公開日:2020-07-22
識別子（ID）:3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propanenitrile
SUC
SUC
表記:SUCROSE
組成式:C12 H22 O11
SMILES:O1C(CO)C(O)C(O)C(O)C1OC2(OC(C(O)C2O)CO)CO
InChi:InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1
定義日:1999-07-08
最終更新日:2020-07-17
識別子（ID）:beta-D-fructofuranosyl alpha-D-glucopyranoside
SUP
SUP
表記:SUCROSE-6-PHOSHPATE
組成式:C12 H23 O14 P
SMILES:O=P(O)(O)OCC2OC(OC1OC(CO)C(O)C(O)C1O)(C(O)C2O)CO
InChi:InChI=1S/C12H23O14P/c13-1-4-6(15)8(17)9(18)11(24-4)26-12(3-14)10(19)7(16)5(25-12)2-23-27(20,21)22/h4-11,13-19H,1-3H2,(H2,20,21,22)/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1
定義日:2004-08-12
最終更新日:2020-07-17
識別子（ID）:6-O-phosphono-beta-D-fructofuranosyl alpha-D-glucopyranoside
SUS
SUS
表記:2-deoxy-3,6-di-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose
組成式:C6 H13 N O14 S3
SMILES:N(C1C(OC(C(C1OS(O)(=O)=O)O)COS(=O)(O)=O)O)S(=O)(O)=O
InChi:InChI=1S/C6H13NO14S3/c8-4-2(1-19-23(13,14)15)20-6(9)3(7-22(10,11)12)5(4)21-24(16,17)18/h2-9H,1H2,(H,10,11,12)(H,13,14,15)(H,16,17,18)/t2-,3-,4-,5-,6+/m1/s1
別名:3,6-di-O-sulfo-N-sulfo-alpha-D-glucosamine
定義日:2009-08-18
最終更新日:2020-07-17
識別子（ID）:2-deoxy-3,6-di-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose

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