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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP015948

vitisinol B

Formula: C35H26O8  |  Mol. Weight: 574.60 g/mol

IUPAC: 4-hydroxy-3-[(1S,8S,9R,16S)-4,6,12-trihydroxy-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.02,7.014,17]heptadeca-2(7),3,5,10(17),11,13-hexaen-9-yl]benzaldehyde

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Overview

Molecular Formula C35H26O8
Molecular Weight 574.60 g/mol
Canonical SMILES C1=CC(=CC=C1C2C(C3=C4C(C(OC4=CC(=C3)O)C5=CC=C(C=C5)O)C6=C2C(=CC(=C6)O)O)C7=C(C=CC(=C7)C=O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy