Chem
J-GLOBAL ID：200907069708586480   Nikkaji number：J641.638A

Camarinic acid

カマリン酸
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： C32H48O6
Molecular formula furigana： C32-H48-O6
Molecular weight： 528.730
InChI： InChI=1S/C32H48O6/c1-18-16-24(38-20(3)33)31(26(34)35)14-12-28(6)21(25(31)19(18)2)8-9-23-29(28,7)11-10-22-27(4,5)32(36)15-13-30(22,23)17-37-32/h8,18-19,22-25,36H,9-17H2,1-7H3,(H,34,35)/t18-,19+,22+,23+,24-,25+,28-,29-,30-,31-,32+/m1/s1
InChI key： BVPSHWDVSJULFR-XEXVZANXSA-N
SMILES： C[C@@H]1C[C@@H](OC(=O)C)[C@@]2(CC[C@]3(C)C(=CC[C@H]4[C@@]3(C)CC[C@H]3C(C)(C)[C@]5(O)CC[C@]43CO5)[C@@H]2[C@H]1C)C(=O)O
Systematic name  (3)：
  • 22β-アセトキシ-3,25-エポキシ-3α-ヒドロキシウルサ-12-エン-28-酸
  • (1S,2S,6S,7S,8R,10R,11S,14S,15R,18R,20S)-10-(アセチルオキシ)-20-ヒドロキシ-7,8,14,15,19,19-ヘキサメチル-21-オキサヘキサシクロ[18.2.2.01,18.02,15.05,14.06,11]テトラコサ-4-エン-11-カルボン酸
  • (1S,2S,6S,7S,8R,10R,11S,14S,15R,18R,20S)-10-(acetyloxy)-20-hydroxy-7,8,14,15,19,19-hexamethyl-21-oxahexacyclo[18.2.2.01,18.02,15.05,14.06,11]tetracos-4-ene-11-carboxylic acid
Other name (4)：
  • カマリン酸
  • Camarinic acid
  • 22β-アセトキシラント酸
  • 22β-Acetoxylantic acid
CAS registry number： 163565-67-1
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