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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP029301

23-Hydroxyphysalolactone

Formula: C28H39ClO9  |  Mol. Weight: 555.10 g/mol

IUPAC: 2-[1-(6-chloro-4,5,14,17-tetrahydroxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-17-yl)-1-hydroxyethyl]-3-hydroxy-4,5-dimethyl-2,3-dihydropyran-6-one

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Overview

Molecular Formula C28H39ClO9
Molecular Weight 555.10 g/mol
Canonical SMILES CC1=C(C(=O)OC(C1O)C(C)(C2(CCC3(C2(CCC4C3CC(C5(C4(C(=O)C=CC5O)C)O)Cl)C)O)O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy