Chemical Compound

Calcipotriol

CAS Registry Number 112965-21-6
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Calcipotriol chemical structure
Primary Record

Calcipotriol

In stock
8,207 g
Purity
99.7 %
CAS
112965-21-6

Compound Identifiers & Properties

CAS
112965-21-6
PubChem CID
71296904
SMILES
CC(C=CC(C1CC1)O)C2CCC3[C@@]2(CCCC3=CC=C4CC(CC(C4=C)O)O)C
Canonical SMILES
C=C1C(=CC=C2CCC[C@@]3(C)C2CCC3C(C)C=CC(O)C2CC2)CC(O)CC1O

Names & Synonyms

  • Calcipotriol
  • calcipotriene
  • HMS3393N11
  • 112965-21-6
  • 112828-00-9
  • (1S,3S,5Z)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(E,2S)-5-Cyclopropyl-5-hydroxy-pent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol
  • (1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
  • 910133-70-9