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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017820

Norcaesalpinin E

Formula: C21H28O6  |  Mol. Weight: 376.40 g/mol

IUPAC: [(1S,4aR,6S,6aS,11aS,11bS)-4a,6-dihydroxy-4,4,11b-trimethyl-7-oxo-1,2,3,5,6,6a,11,11a-octahydronaphtho[2,1-f][1]benzofuran-1-yl] acetate

Overview

Molecular Formula C21H28O6
Molecular Weight 376.40 g/mol
Canonical SMILES CC(=O)OC1CCC(C2(C1(C3CC4=C(C=CO4)C(=O)C3C(C2)O)C)O)(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy