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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP027679

[(1S,3S,4aS,6S,6aS,7R,8R,10aS,10bS)-1-acetyloxy-7,8-dihydroxy-4a,6a,7,10b-tetramethyl-2'-oxospiro[1,2,5,6,8,9,10,10a-octahydrobenzo[f]chromene-3,4'-oxolane]-6-yl] benzoate

Formula: C29H38O9  |  Mol. Weight: 530.60 g/mol

IUPAC: [(1S,3S,4aS,6S,6aS,7R,8R,10aS,10bS)-1-acetyloxy-7,8-dihydroxy-4a,6a,7,10b-tetramethyl-2'-oxospiro[1,2,5,6,8,9,10,10a-octahydrobenzo[f]chromene-3,4'-oxolane]-6-yl] benzoate

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Overview

Molecular Formula C29H38O9
Molecular Weight 530.60 g/mol
Canonical SMILES CC(=O)OC1CC2(CC(=O)OC2)OC3(C1(C4CCC(C(C4(C(C3)OC(=O)C5=CC=CC=C5)C)(C)O)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy