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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP019782

henricioside H2

Formula: C35H58O10  |  Mol. Weight: 638.80 g/mol

IUPAC: (3S,6R,8S,9R,10R,13R,14S,15R,16R,17R)-3-[(2S,3R,4S,5R)-5-hydroxy-3,4-dimethoxyoxan-2-yl]oxy-17-[(E,2R,5R,6S)-7-hydroxy-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,3,6,7,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-6,8,15,16-tetrol

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Overview

Molecular Formula C35H58O10
Molecular Weight 638.80 g/mol
Canonical SMILES CC(CO)C(C)C=CC(C)C1C(C(C2C1(CCC3C2(CC(C4=CC(CCC34C)OC5C(C(C(CO5)O)OC)OC)O)O)C)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy