Chem
J-GLOBAL ID：201107004291737319   Nikkaji number：J2.936.102I

Pterisolic acid F

プテリソル酸F
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： C20H30O6
Molecular formula furigana： C20-H30-O6
Molecular weight： 366.454
InChI： InChI=1S/C20H30O6/c1-16(15(23)24)6-3-7-17(2)13(16)5-8-18-10-12(4-9-20(17,18)26)19(25,11-21)14(18)22/h12-13,21,25-26H,3-11H2,1-2H3,(H,23,24)/t12-,13+,16+,17+,18-,19-,20+/m0/s1
InChI key： DEXISWHCLDQHNE-MFTDSIJKSA-N
SMILES： C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@H](CC[C@@]21O)[C@@](O)(CO)C3=O)C(=O)O
Systematic name  (3)：
  • (13S)-15-オキソ-9,16,17-トリヒドロキシカウラン-18-酸
  • (1R,4S,5R,9R,10R,13S,14R)-10,14-ジヒドロキシ-14-(ヒドロキシメチル)-5,9-ジメチル-15-オキソテトラシクロ[11.2.1.01,10.04,9]ヘキサデカン-5-カルボン酸
  • (1R,4S,5R,9R,10R,13S,14R)-10,14-dihydroxy-14-(hydroxymethyl)-5,9-dimethyl-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Other name (3)：
  • (13S)-15-Oxo-9,16,17-trihydroxykaurane-18-oic acid
  • プテリソル酸F
  • Pterisolic acid F
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