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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013575

norcaesalpinin B

Formula: C23H30O7  |  Mol. Weight: 418.50 g/mol

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

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Overview

Molecular Formula C23H30O7
Molecular Weight 418.50 g/mol
Canonical SMILES CC(=O)OC1CC(C2(C3CC4=C(C=CO4)C(=O)C3CCC2(C1(C)C)O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy