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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP030957

HeteroclitalignanA

Formula: C31H32O11  |  Mol. Weight: 580.60 g/mol

IUPAC: [(8S,9S,10S,11R)-8-acetyloxy-9,19-dihydroxy-3,4,5-trimethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-yl] benzoate

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Overview

Molecular Formula C31H32O11
Molecular Weight 580.60 g/mol
Canonical SMILES CC1C(C2=CC3=C(C(=C2C4=C(C(=C(C=C4C(C1(C)O)OC(=O)C)OC)OC)OC)O)OCO3)OC(=O)C5=CC=CC=C5

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy