Chem
J-GLOBAL ID：200907020380136237   Nikkaji number：J2.330.672G

Sarcophytonolide E

サルコフィトノリドE
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： C20H32O3
Molecular formula furigana： C20-H32-O3
Molecular weight： 320.473
InChI： InChI=1S/C20H32O3/c1-13(2)18-9-8-14(3)6-5-7-15(4)10-17(21)11-16-12-19(18)23-20(16)22/h6,12-13,15,17-19,21H,5,7-11H2,1-4H3/t15-,17-,18-,19+/m0/s1
InChI key： ZHOQSUGYUQVEER-DSLXNQLJSA-N
SMILES： CC(C)[C@@H]1CCC(=CCC[C@H](C)C[C@H](O)CC2=C[C@H]1OC2=O)C
Systematic name  (3)：
  • (1S)-11α-ヒドロキシ-2α-イソプロピル-5,9α-ジメチル-15-オキサビシクロ[11.2.1]ヘキサデカ-5,13(16)-ジエン-14-オン
  • (3S,5S,12S,13S)-3-ヒドロキシ-5,9-ジメチル-12-(プロパン-2-イル)-14-オキサビシクロ[11.2.1]ヘキサデカ-1(16),8-ジエン-15-オン
  • (3S,5S,12S,13S)-3-hydroxy-5,9-dimethyl-12-(propan-2-yl)-14-oxabicyclo[11.2.1]hexadeca-1(16),8-dien-15-one
Other name (3)：
  • (1S)-11α-Hydroxy-2α-isopropyl-5,9α-dimethyl-15-oxabicyclo[11.2.1]hexadeca-5,13(16)-diene-14-one
  • Sarcophytonolide E
  • サルコフィトノリドE
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