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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031615

9,10-dihydroxy-3-(hydroxymethyl)-7-methoxy-3,8-dimethyl-5-(2,5,10-trihydroxy-7-methoxy-2,6-dimethyl-4-oxo-1,3-dihydroanthracen-9-yl)-4H-benzo[g]isochromen-1-one

Formula: C34H34O11  |  Mol. Weight: 618.60 g/mol

IUPAC: 9,10-dihydroxy-3-(hydroxymethyl)-7-methoxy-3,8-dimethyl-5-(2,5,10-trihydroxy-7-methoxy-2,6-dimethyl-4-oxo-1,3-dihydroanthracen-9-yl)-4H-benzo[g]isochromen-1-one

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Overview

Molecular Formula C34H34O11
Molecular Weight 618.60 g/mol
Canonical SMILES CC1=C(C=C2C(=C3CC(CC(=O)C3=C(C2=C1O)O)(C)O)C4=C5CC(OC(=O)C5=C(C6=C(C(=C(C=C46)OC)C)O)O)(C)CO)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy