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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007568

[(1S,2S,3R,5S,8R,9R,10R)-2,9,10-triacetyloxy-1-hydroxy-8,12,15,15-tetramethyl-4-methylidene-13-oxo-5-tricyclo[9.3.1.03,8]pentadec-11-enyl] 2-(dimethylamino)-3-phenylpropanoate

Formula: C37H49NO10  |  Mol. Weight: 667.80 g/mol

IUPAC: [(1S,2S,3R,5S,8R,9R,10R)-2,9,10-triacetyloxy-1-hydroxy-8,12,15,15-tetramethyl-4-methylidene-13-oxo-5-tricyclo[9.3.1.03,8]pentadec-11-enyl] 2-(dimethylamino)-3-phenylpropanoate

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Overview

Molecular Formula C37H49NO10
Molecular Weight 667.80 g/mol
Canonical SMILES CC1=C2C(C(C3(CCC(C(=C)C3C(C(C2(C)C)(CC1=O)O)OC(=O)C)OC(=O)C(CC4=CC=CC=C4)N(C)C)C)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy