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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003372

1-Deacetoxy-1-oxocaesalmin

Formula: C24H30O7  |  Mol. Weight: 430.50 g/mol

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

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Overview

Molecular Formula C24H30O7
Molecular Weight 430.50 g/mol
Canonical SMILES CC(=O)OC1C2C(CC3=C(C2=C)C=CO3)C4(C(=O)CCC(C4(C1OC(=O)C)O)(C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy