Chemical Compound

canellin C

CAS Registry Number 54835-72-2
canellin C chemical structure
Primary Record

canellin C

In stock
6,921 g
Purity
98.9 %
CAS
54835-72-2

Compound Identifiers & Properties

CAS
54835-72-2
PubChem CID
44559515
SMILES
C[C@H]1[C@@H]([C@]2([C@@H](C(=O)C[C@@]1([C@H]2O)CC=C)O)OC)C3=CC4=C(C=C3)OCO4
Canonical SMILES
C=CC[C@@]12CC(=O)[C@@H](O)[C@@](OC)([C@@H]1O)[C@@H](c1ccc3c(c1)OCO3)[C@@H]2C

Names & Synonyms

  • canellin C
  • RefChem:123201
  • CHEMBL469849
  • BDBM50242093
  • J2.069.396G
  • (1S,2S,5S,6S,7R,8R)-7-(1,3-benzodioxol-5-yl)-2,8-dihydroxy-1-methoxy-6-methyl-5-prop-2-enylbicyclo(3.2.1)octan-3-one
  • (1S,2S,5S,6S,7R,8R)-7-(1,3-benzodioxol-5-yl)-2,8-dihydroxy-1-methoxy-6-methyl-5-prop-2-enylbicyclo[3.2.1]octan-3-one
  • (1S,2S,5S,6S,7R,8R)-7-(2H-1,3-benzodioxol-5-yl)-2,8-dihydroxy-1-methoxy-6-methyl-5-(prop-2-en-1-yl)bicyclo[3.2.1]octan-3-one
  • (1S,4S,5S,6R,7S,8R)-1-Allyl-4,8-dihydroxy-5-methoxy-6-(1,3-benzodioxole-5-yl)-7-methylbicyclo[3.2.1]octane-3-one
  • 54835-72-2