Chem
J-GLOBAL ID：200907008050018645   Nikkaji number：J1.003.619D

2-Oxo-19-hydroxy-5α-urs-12-ene-28-oic acid

2-オキソ-19-ヒドロキシ-5α-ウルサ-12-エン-28-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/c1-18-10-13-30(24(32)33)15-14-27(5)20(23(30)29(18,7)34)8-9-22-26(4)17-19(31)16-25(2,3)21(26)11-12-28(22,27)6/h8,18,21-23,34H,9-17H2,1-7H3,(H,32,33)/t18-,21+,22-,23-,26+,27-,28-,29-,30+/m1/s1
InChI key： RAGOCOFSEPOKRD-YDZFFPLRSA-N
SMILES： C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC(=O)CC(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(=O)O
Systematic name  (3)：
  • 2-オキソ-19-ヒドロキシ-5α-ウルサ-12-エン-28-酸
  • (1R,2R,4aS,6aS,6bR,8aS,12aS,12bR,14bS)-1-ヒドロキシ-1,2,6a,6b,9,9,12a-ヘプタメチル-11-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-4a-カルボン酸
  • (1R,2R,4aS,6aS,6bR,8aS,12aS,12bR,14bS)-1-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-11-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
Other name (1)：
  • 2-Oxo-19-hydroxy-5α-urs-12-ene-28-oic acid
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM