Chem
J-GLOBAL ID：200907016071216385   Nikkaji number：J1.228.090D

ONO-8711

ONO-8711
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C22H30ClNO4S
Molecular formula furigana： C22-H30-CL-N-O4-S
Molecular weight： 440.000
InChI： InChI=1S/C22H30ClNO4S/c1-15-13-18(23)11-12-21(15)29(27,28)24-14-20-17-9-7-16(8-10-17)19(20)5-3-2-4-6-22(25)26/h3,5,11-13,16-17,19-20,24H,2,4,6-10,14H2,1H3,(H,25,26)/b5-3-/t16?,17?,19-,20+/m1/s1
InChI key： VVEXPDRCGCQELD-NHIVGFGBSA-N
SMILES： Cc1cc(Cl)ccc1S(=O)(=O)NC[C@H]1C2CCC(CC2)[C@H]1/C=C\CCCC(=O)O
Systematic name  (3)：
  • (Z)-6-[(2S,3S)-3-(4-クロロ-2-メチルフェニルスルホニルアミノメチル)-ビシクロ[2.2.2]オクタン-2-イル]-5-ヘキセン酸
  • (5Z)-6-[(2S,3S)-3-[(4-クロロ-2-メチルベンゼンスルホンアミド)メチル]ビシクロ[2.2.2]オクタン-2-イル]ヘキサ-5-エン酸
  • (5Z)-6-[(2S,3S)-3-[(4-chloro-2-methylbenzenesulfonamido)methyl]bicyclo[2.2.2]octan-2-yl]hex-5-enoic acid
Other name (2)：
  • (Z)-6-[(2S,3S)-3-(4-Chloro-2-methylphenylsulfonylaminomethyl)-bicyclo[2.2.2]octane-2-yl]-5-hexenoic acid
  • ONO-8711
Thsaurus map：
Thesaurus Map

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