Chemical Compound

okadaic acid

CAS Registry Number 78111-17-8
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okadaic acid chemical structure
Primary Record

okadaic acid

In stock
599 g
Purity
99.4 %
CAS
78111-17-8

Compound Identifiers & Properties

CAS
78111-17-8
PubChem CID
45356271
SMILES
C[C@@H]1CC[C@]2(CCCCO2)O[C@@H]1[C@@H](C)C[C@@H]([C@@H]3C(=C)[C@H]([C@H]4[C@H](O3)CC[C@@]5(O4)CC[C@@H](O5)/C=C/[C@@H](C)[C@H]6CC(=C[C@@]7(O6)[C@@H](CC[C@H](O7)C[C@](C)(C(=O)O)O)O)C)O)O
Canonical SMILES
C=C1[C@@H](O)[C@@H]2O[C@@]3(CC[C@H](/C=C/[C@@H](C)[C@H]4CC(C)=C[C@@]5(O[C@H](C[C@@](C)(O)C(=O)O)CC[C@H]5O)O4)O3)CC[C@H]2O[C@@H]1[C@@H](O)C[C@H](C)[C@H]1O[C@@]2(CCCCO2)CC[C@H]1C

Names & Synonyms

  • okadaic acid
  • halochondrine A
  • BIDD:PXR0192
  • UNII-1W21G5Q4N2
  • CCRIS 3329
  • HSDB 7243
  • C44-H68-O13
  • 9,10-Deepithio-9,10-didehydroacanthifolicin
  • 78111-17-8
  • 1,7-Dioxaspiro[5.5]undec-10-ene-2-propanoic acid, .alpha.,5-dihydroxy-.alpha.,10-dimethyl-8-[(1R,2E)-1-methyl-3-[(2R,4'aR,5R,6'S,8'R,8'aS)-octahydro-8'-hydroxy-6'-[(1S,3S)-1-hydroxy-3-[(2S,3R,6S)-3-methyl-1,7-dioxaspiro[5.5]undec-2-yl]butyl]-7'-methylenes