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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038539

6,7-dihydroxy-13-methoxy-14-[(2S,3S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

Formula: C21H18O13  |  Mol. Weight: 478.40 g/mol

IUPAC: 6,7-dihydroxy-13-methoxy-14-[(2S,3S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

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Overview

Molecular Formula C21H18O13
Molecular Weight 478.40 g/mol
Canonical SMILES COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4O)O)C(=O)O2)OC5C(C(C(C(O5)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy