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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012645

Plectranthone

Formula: C19H28O5  |  Mol. Weight: 336.40 g/mol

IUPAC: [(1R,2S,4aR,8aR)-1-acetyloxy-8-methyl-6-oxo-2-propan-2-yl-1,2,3,4,5,8a-hexahydronaphthalen-4a-yl]methyl acetate

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Overview

Molecular Formula C19H28O5
Molecular Weight 336.40 g/mol
Canonical SMILES CC1=CC(=O)CC2(C1C(C(CC2)C(C)C)OC(=O)C)COC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy