Chem
J-GLOBAL ID：200907045632891869   Nikkaji number：J12.856B

Sericic acid

セリク酸
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： C30H48O6
Molecular formula furigana： C30-H48-O6
Molecular weight： 504.708
InChI： InChI=1S/C30H48O6/c1-25(2)11-13-30(24(35)36)14-12-28(5)17(21(30)23(25)34)7-8-20-26(3)15-18(32)22(33)27(4,16-31)19(26)9-10-29(20,28)6/h7,18-23,31-34H,8-16H2,1-6H3,(H,35,36)/t18-,19-,20-,21-,22+,23+,26+,27-,28-,29-,30+/m1/s1
InChI key： IFIQVSCCFRXSJV-GOVAGAJPSA-N
SMILES： CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@@H]1O)C(=O)O
Systematic name  (3)：
  • (4S)-2α,3β,19α,23-テトラヒドロキシオレアナ-12-エン-28-酸
  • (1S,4aR,6aS,6bR,8aR,9S,10R,11R,12aR,12bR,14bS)-1,10,11-トリヒドロキシ-9-(ヒドロキシメチル)-2,2,6a,6b,9,12a-ヘキサメチル-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
  • (1S,4aR,6aS,6bR,8aR,9S,10R,11R,12aR,12bR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-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 (3)：
  • セリク酸
  • Sericic acid
  • (4S)-2α,3β,19α,23-Tetrahydroxyolean-12-en-28-oic acid
CAS registry number： 55306-03-1
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