Chem
J-GLOBAL ID：200907055521660570   Nikkaji number：J2.769.132C

Libanorin

リバノリン
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： C19H20O5
Molecular formula furigana： C19-H20-O5
Molecular weight： 328.364
InChI： InChI=1S/C19H20O5/c1-11(2)9-17(21)24-19(3,4)15-10-13-14(22-15)7-5-12-6-8-16(20)23-18(12)13/h5-9,15H,10H2,1-4H3/t15-/m0/s1
InChI key： YCXXSERNLQPDHF-HNNXBMFYSA-N
SMILES： CC(=CC(=O)OC(C)(C)[C@@H]1Cc2c(O1)ccc1ccc(=O)oc21)C
Systematic name  (4)：
  • 3-メチル-2-ブテン酸1-[(8S)-8,9-ジヒドロ-2-オキソ-2H-フロ[2,3-h]-1-ベンゾピラン-8-イル]-1-メチルエチル
  • 3-メチル-2-ブテン酸1-(8,9-ジヒドロ-2-オキソ-2H-フロ[2,3-h]-1-ベンゾピラン-8α-イル)-1-メチルエチル
  • 2-[(8S)-2-オキソ-2H,8H,9H-フロ[2,3-h]クロメン-8-イル]プロパン-2-イル 3-メチルブタ-2-エノアート
  • 2-[(8S)-2-oxo-2H,8H,9H-furo[2,3-h]chromen-8-yl]propan-2-yl 3-methylbut-2-enoate
Other name (4)：
  • 3-Methyl-2-butenoic acid 1-[(8S)-8,9-dihydro-2-oxo-2H-furo[2,3-h]-1-benzopyran-8-yl]-1-methylethyl ester
  • Libanorin
  • リバノリン
  • 3-Methyl-2-butenoic acid 1-(8,9-dihydro-2-oxo-2H-furo[2,3-h]-1-benzopyran-8α-yl)-1-methylethyl ester
CAS registry number： 27303-26-0
KEGG COMPOUND： C09272
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