Chem
J-GLOBAL ID：200907061759782118   Nikkaji number：J1.333.518D

3-Oxo-22α-hydroxyoleana-12-ene-29-oic acid

3-オキソ-22α-ヒドロキシオレアナ-12-エン-29-酸
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： C30H46O4
Molecular formula furigana： C30-H46-O4
Molecular weight： 470.694
InChI： InChI=1S/C30H46O4/c1-25(2)20-10-13-30(7)21(28(20,5)12-11-22(25)31)9-8-18-19-16-26(3,24(33)34)17-23(32)27(19,4)14-15-29(18,30)6/h8,19-21,23,32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21+,23-,26-,27+,28-,29+,30+/m0/s1
InChI key： RUJQEBHXYLCSKV-TYNJRVMBSA-N
SMILES： CC1(C)[C@@H]2CC[C@]3(C)[C@H](CC=C4[C@@H]5C[C@@](C)(C[C@H](O)[C@]5(C)CC[C@@]34C)C(=O)O)[C@@]2(C)CCC1=O
Systematic name  (3)：
  • 3-オキソ-22α-ヒドロキシオレアナ-12-エン-29-酸
  • (2S,4S,4aR,6aS,6bR,8aR,12aR,12bR,14bS)-4-ヒドロキシ-2,4a,6a,6b,9,9,12a-ヘプタメチル-10-オキソ-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-イコサヒドロピセン-2-カルボン酸
  • (2S,4S,4aR,6aS,6bR,8aR,12aR,12bR,14bS)-4-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-2-carboxylic acid
Other name (1)：
  • 3-Oxo-22α-hydroxyoleana-12-ene-29-oic acid
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM