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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP014637

Allobetulin

Formula: C30H50O2  |  Mol. Weight: 442.70 g/mol

IUPAC: (1R,4R,5R,8R,10S,13R,14R,17R,18R,19R)-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[17.3.2.01,18.04,17.05,14.08,13]tetracosan-10-ol

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Overview

Molecular Formula C30H50O2
Molecular Weight 442.70 g/mol
Canonical SMILES CC1(CCC23CCC4(C(C2C1OC3)CCC5C4(CCC6C5(CCC(C6(C)C)O)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy