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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006319

(5R,7R,8S,10S)-8-hydroxy-10-methyl-7-propan-2-yl-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-dien-11-one

Formula: C21H30O9  |  Mol. Weight: 426.50 g/mol

IUPAC: (5R,7R,8S,10S)-8-hydroxy-10-methyl-7-propan-2-yl-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-oxatricyclo[6.3.1.04,12]dodeca-1(12),3-dien-11-one

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Overview

Molecular Formula C21H30O9
Molecular Weight 426.50 g/mol
Canonical SMILES CC1CC2(C(CC(C3=COC(=C32)C1=O)OC4C(C(C(C(O4)CO)O)O)O)C(C)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy