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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008224

4,5-dihydroxy-2-methyl-1-[(10S)-1,8,10-trihydroxy-6-methyl-9-oxo-10-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]anthracen-2-yl]anthracene-9,10-dione

Formula: C35H28O12  |  Mol. Weight: 640.60 g/mol

IUPAC: 4,5-dihydroxy-2-methyl-1-[(10S)-1,8,10-trihydroxy-6-methyl-9-oxo-10-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]anthracen-2-yl]anthracene-9,10-dione

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Overview

Molecular Formula C35H28O12
Molecular Weight 640.60 g/mol
Canonical SMILES CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2(C4C(C(C(CO4)O)O)O)O)C=CC(=C3O)C5=C6C(=C(C=C5C)O)C(=O)C7=C(C6=O)C=CC=C7O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy