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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009599

[(2R,3S,4S,5R,6S)-6-(7-acetyl-8-hydroxy-6-methylnaphthalen-1-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate

Formula: C21H24O9  |  Mol. Weight: 420.40 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-6-(7-acetyl-8-hydroxy-6-methylnaphthalen-1-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl acetate

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Overview

Molecular Formula C21H24O9
Molecular Weight 420.40 g/mol
Canonical SMILES CC1=CC2=C(C(=CC=C2)OC3C(C(C(C(O3)COC(=O)C)O)O)O)C(=C1C(=O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy