Chem
J-GLOBAL ID：201107045988542727   Nikkaji number：J2.915.667K

Solanacol

ソラナコール
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： C19H18O6
Molecular formula furigana： C19-H18-O6
Molecular weight： 342.347
InChI： InChI=1S/C19H18O6/c1-8-4-5-11-14(10(8)3)17-15(16(11)20)12(19(22)25-17)7-23-13-6-9(2)18(21)24-13/h4-7,13,15-17,20H,1-3H3/t13-,15-,16+,17+/m1/s1
InChI key： LFVSQVHIKFDYFI-SIXLDLHFSA-N
SMILES： CC1=C[C@H](OC=C2[C@@H]3[C@@H](O)c4ccc(C)c(C)c4[C@@H]3OC2=O)OC1=O
Systematic name  (3)：
  • (4R)-3-[[(R)-2,5-ジヒドロ-5-オキソ-4-メチルフラン-2-イルオキシ]メチレン]-4-ヒドロキシ-7,8-ジメチル-3aβ,8bβ-ジヒドロ-4H-インデノ[1,2-b]フラン-2(3H)-オン
  • (5R)-5-{[(3aR,4R,8bR)-4-ヒドロキシ-7,8-ジメチル-2-オキソ-2H,3H,3aH,4H,8bH-インデノ[1,2-b]フラン-3-イリデン]メトキシ}-3-メチル-2,5-ジヒドロフラン-2-オン
  • (5R)-5-{[(3aR,4R,8bR)-4-hydroxy-7,8-dimethyl-2-oxo-2H,3H,3aH,4H,8bH-indeno[1,2-b]furan-3-ylidene]methoxy}-3-methyl-2,5-dihydrofuran-2-one
Other name (5)：
  • (-)-ソラナコール
  • (-)-Solanacol
  • ソラナコール
  • Solanacol
  • (4R)-3-[[(R)-2,5-Dihydro-5-oxo-4-methylfuran-2-yloxy]methylene]-4-hydroxy-7,8-dimethyl-3aβ,8bβ-dihydro-4H-indeno[1,2-b]furan-2(3H)-one
CAS registry number： 953389-72-5
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