Chem
J-GLOBAL ID：200907036241819196   Nikkaji number：J2.536.109A

(+)-Gossypol

(+)-ゴッシポール
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： C30H30O8
Molecular formula furigana： C30-H30-O8
Molecular weight： 518.562
InChI： InChI=1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3
InChI key： QBKSWRVVCFFDOT-UHFFFAOYSA-N
SMILES： CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O
Systematic name  (1)：
  • (aS)-1,1′,6,6′,7,7′-ヘキサヒドロキシ-3,3′-ジメチル-5,5′-ジイソプロピル[2,2′-ビナフタレン]-8,8′-ジカルボアルデヒド
Other name (3)：
  • (aS)-1,1′,6,6′,7,7′-Hexahydroxy-3,3′-dimethyl-5,5′-diisopropyl[2,2′-binaphthalene]-8,8′-dicarbaldehyde
  • (+)-ゴッシポール
  • (+)-Gossypol
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