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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012277

25-O-cinnamoylvulgaroside

Formula: C34H46O7  |  Mol. Weight: 566.70 g/mol

IUPAC: [3-[2-[(1R,2S,4aR,4bS,8aS,10aR)-2-hydroxy-2-(hydroxymethyl)-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-1-yl]-1-hydroxyethyl]-5-oxo-2H-furan-2-yl] (E)-3-phenylprop-2-enoate

Overview

Molecular Formula C34H46O7
Molecular Weight 566.70 g/mol
Canonical SMILES CC1(CCCC2(C1CCC3(C2CCC(C3CC(C4=CC(=O)OC4OC(=O)C=CC5=CC=CC=C5)O)(CO)O)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy