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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013211

Bonducellpin D

Formula: C22H28O7  |  Mol. Weight: 404.50 g/mol

IUPAC: [(1S,8S,11R,12S,13R,17S,18S,19R)-13,17-dihydroxy-14,14,18-trimethyl-9-oxo-4,10-dioxapentacyclo[9.7.1.03,7.08,19.013,18]nonadeca-3(7),5-dien-12-yl] acetate

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Overview

Molecular Formula C22H28O7
Molecular Weight 404.50 g/mol
Canonical SMILES CC(=O)OC1C2C3C(CC4=C(C3C(=O)O2)C=CO4)C5(C1(C(CCC5O)(C)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy