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Home/Compounds/API/Atocalcitol
C32H46O4
494.7 g/mol
API

Atocalcitol

CAS302904-82-1
Category
API
Compound Class
Steroid
Primary Use
Pharmaceutical Raw Material

Atocalcitol is a vitamin D derivative and a small molecule drug. It is primarily used as an active pharmaceutical ingredient in pharmaceutical manufacturing and research.

active pharmaceutical ingredient

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

trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R)-1-[[3-(2-hydroxypropan-2-yl)phenyl]methoxy]propan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

InChIKey

CFIFSLBCJAXYTC-FJLAUVHZSA-N

SMILES

C[C@@H](COCC1=CC(=CC=C1)C(C)(C)O)[C@H]2CC[C@@H]\3[C@@]2(CCC/C3=C\C=C/4\C[C@H](C[C@@H](C4=C)O)O)C

Synonyms (8)
  • Atocalcitolum [INN-Latin]
  • Atocalcitol
  • Atocalcitolum