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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP032442

[(1S,2S,4S,7R,9R,13S,14R,15S,16S,17S)-4,15-dimethoxy-2,14,17-trimethyl-3,11-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecan-16-yl] 1,3-benzodioxole-5-carboxylate

Formula: C29H36O9  |  Mol. Weight: 528.60 g/mol

IUPAC: [(1S,2S,4S,7R,9R,13S,14R,15S,16S,17S)-4,15-dimethoxy-2,14,17-trimethyl-3,11-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadecan-16-yl] 1,3-benzodioxole-5-carboxylate

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Overview

Molecular Formula C29H36O9
Molecular Weight 528.60 g/mol
Canonical SMILES CC1C2CC(=O)OC3C2(C(C(C1OC)OC(=O)C4=CC5=C(C=C4)OCO5)C6(C(C3)CCC(C6=O)OC)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy