Chem
J-GLOBAL ID：200907097315097324   Nikkaji number：J17.557I

Friedelin

フリーデリン
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： C30H50O
Molecular formula furigana： C30-H50-O
Molecular weight： 426.729
InChI： InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1
InChI key： OFMXGFHWLZPCFL-SVRPQWSVSA-N
SMILES： C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)[C@@H]3CC(C)(C)CC[C@]3(C)CC[C@]12C
Systematic name  (4)：
  • フリーデラン-3-オン
  • D:A-フリードオレアナン-3-オン
  • (4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-4,4a,6b,8a,11,11,12b,14a-オクタメチル-ドコサヒドロピセン-3-オン
  • (4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-4,4a,6b,8a,11,11,12b,14a-octamethyl-docosahydropicen-3-one
Other name (5)：
  • フリーデリン
  • Friedelin
  • D:A-Friedooleanan-3-one
  • フリエデリン
  • Friedeline
CAS registry number： 559-74-0
Regulation number (1)：
  • EINECS2092051
KEGG COMPOUND： C08626
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