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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036166

Limonin (17-beta-D-glucoside-)

Formula: C56H100O6  |  Mol. Weight: 869.40 g/mol

IUPAC: [(2R)-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-3-[(Z)-tetradec-9-enoyl]oxypropyl] henicosanoate

Overview

Molecular Formula C56H100O6
Molecular Weight 869.40 g/mol
Canonical SMILES CCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCC)OC(=O)CCCCCCCC=CCC=CCC=CCC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy