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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP014239

2-Deacetoxydecinnamoyltaxinine J

Formula: C28H40O9  |  Mol. Weight: 520.60 g/mol

IUPAC: [(1R,3R,5S,7S,8S,9R,10R,13S)-7,9,10-triacetyloxy-5-hydroxy-8,12,15,15-tetramethyl-4-methylidene-13-tricyclo[9.3.1.03,8]pentadec-11-enyl] acetate

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Overview

Molecular Formula C28H40O9
Molecular Weight 520.60 g/mol
Canonical SMILES CC1=C2C(C(C3(C(CC(C2(C)C)CC1OC(=O)C)C(=C)C(CC3OC(=O)C)O)C)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy