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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010849

Nyssoside

Formula: C22H18O13  |  Mol. Weight: 490.40 g/mol

IUPAC: 12-methoxy-13-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5,10,17-tetraoxapentacyclo[9.6.2.02,6.08,18.015,19]nonadeca-1(18),2(6),7,11(19),12,14-hexaene-9,16-dione

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Overview

Molecular Formula C22H18O13
Molecular Weight 490.40 g/mol
Canonical SMILES COC1=C(C=C2C3=C1OC(=O)C4=CC5=C(C(=C43)OC2=O)OCO5)OC6C(C(C(C(O6)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy