Chem
J-GLOBAL ID：201807009374907945   Nikkaji number：J3.680.362B

Isodonterpene I

イソドンテルペンI
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： C20H28O6
Molecular formula furigana： C20-H28-O6
Molecular weight： 364.438
InChI： InChI=1S/C20H28O6/c1-9-10-4-5-11-18-8-26-20(25,19(11,7-10)15(9)23)16(24)14(18)17(2,3)12(21)6-13(18)22/h10-14,16,21-22,24-25H,1,4-8H2,2-3H3/t10-,11+,12-,13+,14-,16+,18-,19+,20-/m1/s1
InChI key： XQVLXTHOXRHJIX-CVCNXPMMSA-N
SMILES： CC1(C)[C@H](O)C[C@H](O)[C@]23CO[C@](O)([C@@H](O)[C@H]12)[C@@]12C[C@@H](CC[C@@H]31)C(=C)C2=O
Systematic name  (3)：
  • 7α,20-エポキシ-1α,3α,6β,7-テトラヒドロキシカウラ-16-エン-15-オン
  • (1S,2S,5R,8S,9S,10S,11R,13R,15S)-9,10,13,15-テトラヒドロキシ-12,12-ジメチル-6-メチリデン-17-オキサペンタシクロ[7.6.2.15,8.01,11.02,8]オクタデカン-7-オン
  • (1S,2S,5R,8S,9S,10S,11R,13R,15S)-9,10,13,15-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one
Other name (3)：
  • 7α,20-Epoxy-1α,3α,6β,7-tetrahydroxykaura-16-ene-15-one
  • イソドンテルペンI
  • Isodonterpene I
Thsaurus map：
Thesaurus Map

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