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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP027729

Lactuside C

Formula: C21H28O9  |  Mol. Weight: 424.40 g/mol

IUPAC: (3S,3aS,5R,9aS,9bS)-3,6,9-trimethyl-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione

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Overview

Molecular Formula C21H28O9
Molecular Weight 424.40 g/mol
Canonical SMILES CC1C2CC(C(=C3C(C2OC1=O)C(=CC3=O)C)C)OC4C(C(C(C(O4)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy