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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006122

(4R)-4-[(3R)-3-[(6-O-D-Apio-I(2)-D-furanosyl-I(2)-D-glucopyranosyl)oxy]butyl]-3,5,5-trimethyl-2-cyclohexen-1-one

Formula: C24H40O11  |  Mol. Weight: 504.60 g/mol

IUPAC: (4R)-4-[(3R)-3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxybutyl]-3,5,5-trimethylcyclohex-2-en-1-one

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Overview

Molecular Formula C24H40O11
Molecular Weight 504.60 g/mol
Canonical SMILES CC1=CC(=O)CC(C1CCC(C)OC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O)(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy