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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP029356

Cassiaside B

Formula: C26H30O14  |  Mol. Weight: 566.50 g/mol

IUPAC: 6-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxy-8-methoxy-2-methylbenzo[g]chromen-4-one

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Overview

Molecular Formula C26H30O14
Molecular Weight 566.50 g/mol
Canonical SMILES CC1=CC(=O)C2=C(C3=C(C=C(C=C3C=C2O1)OC)OC4C(C(C(C(O4)COC5C(C(CO5)(CO)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy