Chem
J-GLOBAL ID：200907016867675071   Nikkaji number：J408.634A

Smenospondiol

スメノスポンジオール
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： C23H32O4
Molecular formula furigana： C23-H32-O4
Molecular weight： 372.505
InChI： InChI=1S/C23H32O4/c1-14-7-6-8-19-22(14,3)10-9-15(2)23(19,4)13-17-11-16(21(26)27-5)12-18(24)20(17)25/h11-12,15,19,24-25H,1,6-10,13H2,2-5H3/t15-,19+,22+,23+/m1/s1
InChI key： FMHCCRKQMUIWGQ-KKPDNJFZSA-N
SMILES： COC(=O)c1cc(O)c(O)c(C[C@@]2(C)[C@H](C)CC[C@]3(C)[C@@H]2CCCC3=C)c1
Systematic name  (3)：
  • 3-[[(1S,8aβ)-デカヒドロ-1,2α,4aα-トリメチル-5-メチレンナフタレン]-1β-イルメチル]-4,5-ジヒドロキシ安息香酸メチル
  • メチル 3-{[(1S,2R,4aR,8aR)-1,2,4a-トリメチル-5-メチリデン-デカヒドロナフタレン-1-イル]メチル}-4,5-ジヒドロキシベンゾアート
  • methyl 3-{[(1S,2R,4aR,8aR)-1,2,4a-trimethyl-5-methylidene-decahydronaphthalen-1-yl]methyl}-4,5-dihydroxybenzoate
Other name (3)：
  • スメノスポンジオール
  • Smenospondiol
  • 3-[[(1S,8aβ)-Decahydro-1,2α,4aα-trimethyl-5-methylenenaphthalen]-1β-ylmethyl]-4,5-dihydroxybenzoic acid methyl ester
Thsaurus map：
Thesaurus Map

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