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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013819

Tithofolinolide

Formula: C21H30O8  |  Mol. Weight: 410.50 g/mol

IUPAC: [(3aR,4R,5aR,6R,8S,9S,9aS,9bS)-8-acetyloxy-6,9-dihydroxy-5a,9-dimethyl-3-methylidene-2-oxo-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-4-yl] 2-methylpropanoate

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Overview

Molecular Formula C21H30O8
Molecular Weight 410.50 g/mol
Canonical SMILES CC(C)C(=O)OC1CC2(C(CC(C(C2C3C1C(=C)C(=O)O3)(C)O)OC(=O)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy