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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP030555

7-Deacetoxytaxinine J

Formula: C37H46O10  |  Mol. Weight: 650.80 g/mol

IUPAC: [(1R,2R,3R,5S,8R,9R,10R,13S)-2,9,10,13-tetraacetyloxy-8,12,15,15-tetramethyl-4-methylidene-5-tricyclo[9.3.1.03,8]pentadec-11-enyl] (E)-3-phenylprop-2-enoate

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Overview

Molecular Formula C37H46O10
Molecular Weight 650.80 g/mol
Canonical SMILES CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)CC1OC(=O)C)OC(=O)C)OC(=O)C=CC4=CC=CC=C4)C)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy