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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035958

Kaurenoic acid thujanol ester

Formula: C30H46O2  |  Mol. Weight: 438.70 g/mol

IUPAC: (4-methyl-1-propan-2-ylcyclohex-3-en-1-yl) (1S,4S,5R,9S,10R,13R)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

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Overview

Molecular Formula C30H46O2
Molecular Weight 438.70 g/mol
Canonical SMILES CC1=CCC(CC1)(C(C)C)OC(=O)C2(CCCC3(C2CCC45C3CCC(C4)C(=C)C5)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy