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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003907

(1S,2S,4R,6S,9R,10R,11R,14R,15R)-9-hydroxy-2,9,11,14,19,19-hexamethyl-6-prop-1-en-2-yl-17-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-oxapentacyclo[12.8.0.02,11.04,10.015,20]docosa-16,20-diene-8,13,18-trione

Formula: C36H50O11  |  Mol. Weight: 658.80 g/mol

IUPAC: (1S,2S,4R,6S,9R,10R,11R,14R,15R)-9-hydroxy-2,9,11,14,19,19-hexamethyl-6-prop-1-en-2-yl-17-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-oxapentacyclo[12.8.0.02,11.04,10.015,20]docosa-16,20-diene-8,13,18-trione

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Overview

Molecular Formula C36H50O11
Molecular Weight 658.80 g/mol
Canonical SMILES CC(=C)C1CC(=O)C(C2C(O1)CC3(C2(CC(=O)C4(C3CC=C5C4C=C(C(=O)C5(C)C)OC6C(C(C(C(O6)CO)O)O)O)C)C)C)(C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy