Chemical Compound

Isodonoic acid

CAS Registry Number 84294-78-0
Isodonoic acid chemical structure
Primary Record

Isodonoic acid

In stock
6,028 g
Purity
99.6 %
CAS
84294-78-0

Compound Identifiers & Properties

CAS
84294-78-0
PubChem CID
158480
SMILES
CC(=O)O[C@H]1CCC([C@H]([C@@]12COC(=O)[C@]34[C@H]2[C@H](C[C@H](C3)C(=C)C4=O)O)C(=O)O)(C)C
Canonical SMILES
C=C1C(=O)[C@]23C[C@H]1C[C@H](O)[C@H]2[C@]1(COC3=O)[C@@H](OC(C)=O)CCC(C)(C)[C@H]1C(=O)O

Names & Synonyms

  • Isodonoic acid
  • RefChem:905587
  • AC1L4K0J
  • DTXSID101004595
  • CID158480
  • C22-H28-O8
  • 84294-78-0
  • (1S,1'R,3'S,5S,6S,7S,9S)-3'-acetyloxy-7-hydroxy-6',6'-dimethyl-10-methylidene-2,11-dioxospiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,2'-cyclohexane]-1'-carboxylic acid
  • (1'S,2'R,4aS,5S,6'S,7S,9aS)-6'-(Acetyloxy)hexahydro-5-hydroxy-3',3'-dimethyl-8-methylene-1,9-dioxospiro(1H-7,9a-methanocyclohepta(c)pyran-4(3H),1'-cyclohexane)-2'-carboxylic acid
  • (1S,2R,4'aS,5'S,6S,7'S,9'aS)-6-(Acetyloxy)-5'-hydroxy-3,3-dimethyl-8'-methylidene-1',9'-dioxohexahydro-1'H,3'H-spiro[cyclohexane-1,4'-[7,9a]methanocyclohepta[c]pyran]-2-carboxylic acid
  • 6-(Acetyloxy)-5'-hydroxy-3,3-dimethyl-8'-methylidene-1',9'-dioxohexahydro-1'H,3'H-spiro[cyclohexane-1,4'-[2]oxa[7,9a]methanocyclohepta[c]pyran]-2-carboxylic acid
  • Spiro(cyclohexane-1,4'(3'H)-(1H-7,9a)methanocyclohepta(c)pyran)-2-carboxylic acid, 6-(acetyloxy)hexahydro-5'-hydroxy-3,3-dimethyl-8'-methylene-1',9'-dioxo-, (4'S-(4'alpha(2S*,6R*), 4'abeta,5'beta,7'alpha,9'aalpha))-