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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010964

Panepophenanthrin

Formula: C22H28O8  |  Mol. Weight: 420.50 g/mol

IUPAC: (1S,2S,3R,4S,6S,10S,13R,14S,16S,17R,18S)-3,13,17-trihydroxy-18-[(E)-3-hydroxy-3-methylbut-1-enyl]-11,11-dimethyl-5,12,15-trioxahexacyclo[8.7.1.02,8.04,6.013,18.014,16]octadec-8-en-7-one

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Overview

Molecular Formula C22H28O8
Molecular Weight 420.50 g/mol
Canonical SMILES CC1(C2C=C3C(C4C2(C(O1)(C5C(C4O)O5)O)C=CC(C)(C)O)C(C6C(C3=O)O6)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy