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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP024413

Vitilagin

Formula: C34H26O23  |  Mol. Weight: 802.60 g/mol

IUPAC: [1,11,18,19,23,23-hexahydroxy-2,5,15-trioxo-10-(3,4,5-trihydroxybenzoyl)oxy-6,9,14,24-tetraoxapentacyclo[18.3.1.04,22.08,13.016,21]tetracosa-3,16,18,20-tetraen-12-yl] 3,4,5-trihydroxybenzoate

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Overview

Molecular Formula C34H26O23
Molecular Weight 802.60 g/mol
Canonical SMILES C1C2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C6=C5C7C(=CC(=O)C(C7(O)O)(O6)O)C(=O)O1)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy