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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP082207

Ergocalciferol

Formula: C28H44O  |  Mol. Weight: 396.60 g/mol

IUPAC: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol

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Overview

Molecular Formula C28H44O
Molecular Weight 396.60 g/mol
Canonical SMILES CC(C)C(C)C=CC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Therapeutics & Targets

Disease Associations