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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004119

(2R,3R,4S,5S,6R)-2-[[(2S,4aS,4bR,6S,8S,8aR)-2-[(1S)-1,2-dihydroxyethyl]-6-hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Formula: C26H44O10  |  Mol. Weight: 516.60 g/mol

IUPAC: (2R,3R,4S,5S,6R)-2-[[(2S,4aS,4bR,6S,8S,8aR)-2-[(1S)-1,2-dihydroxyethyl]-6-hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Overview

Molecular Formula C26H44O10
Molecular Weight 516.60 g/mol
Canonical SMILES CC1(CC(CC2(C1CCC3=CC(CCC32)(COC4C(C(C(C(O4)CO)O)O)O)C(CO)O)C)O)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy