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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016898

(E)-4-[(3R,4S)-4-hydroxy-2,6,6-trimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexen-1-yl]but-3-en-2-one

Formula: C19H30O8  |  Mol. Weight: 386.40 g/mol

IUPAC: (E)-4-[(3R,4S)-4-hydroxy-2,6,6-trimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexen-1-yl]but-3-en-2-one

Overview

Molecular Formula C19H30O8
Molecular Weight 386.40 g/mol
Canonical SMILES CC1=C(C(CC(C1OC2C(C(C(C(O2)CO)O)O)O)O)(C)C)C=CC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy