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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017693

cedronolactone A

Formula: C25H34O9  |  Mol. Weight: 478.50 g/mol

IUPAC: [(1R,2S,3R,6R,8S,12S,13S,14R,15R,16S,17S)-12,15,16-trihydroxy-9,13,17-trimethyl-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-9-en-3-yl] 3-methylbutanoate

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Overview

Molecular Formula C25H34O9
Molecular Weight 478.50 g/mol
Canonical SMILES CC1=CC(=O)C(C2(C1CC3C45C2C(C(C(C4C(C(=O)O3)OC(=O)CC(C)C)(OC5)C)O)O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy