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Home/Compounds/Other/1β-calcitriol
C27H44O3
416.6 g/mol
Other

1beta-Calcitriol

CAS66791-71-7
Category
Other
Compound Class
n.a
Primary Use
research reagent

1β-Calcitriol is a naturally occurring isomer of calcitriol, the active form of vitamin D3. It has been identified in the plant Solanum glaucophyllum.

research compound for vitamin D analog studiespharmaceutical intermediate for active vitamin D derivatives

Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.

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Identifiers
IUPAC Name

cis-(1R,3R,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

InChIKey

GMRQFYUYWCNGIN-PEJFXWBPSA-N

SMILES

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@H](C3=C)O)O)C

Synonyms (17)
  • Calcitriol EP Impurity B
  • 1-Epicalcitriol
  • 1beta,25-Dihydroxyvitamin-D3
  • 1beta-Calcitriol
  • Calcitriol impurity B
  • Epi-Calcitriol
  • Impurity B of Calcitriol
  • NS 8