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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008539

Neopanaxadiol

Formula: C30H52O3  |  Mol. Weight: 460.70 g/mol

IUPAC: (3S,5R,8R,9R,10R,12R,13R,14R,17S)-17-[(E)-6-hydroxy-6-methylhept-2-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol

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Overview

Molecular Formula C30H52O3
Molecular Weight 460.70 g/mol
Canonical SMILES CC(=CCCC(C)(C)O)C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)O)C)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy