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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000726

3-(hydroxymethyl)-2,4,4-trimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexa-2,5-dien-1-one

Formula: C16H24O8  |  Mol. Weight: 344.36 g/mol

IUPAC: 3-(hydroxymethyl)-2,4,4-trimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexa-2,5-dien-1-one

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Overview

Molecular Formula C16H24O8
Molecular Weight 344.36 g/mol
Canonical SMILES CC1=C(C(C=C(C1=O)OC2C(C(C(C(O2)CO)O)O)O)(C)C)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy