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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP020085

methyl 2-[(1S,6aR,7R,8S,10S,10aS,10bS,11S,11aS)-8-acetyloxy-1-(furan-3-yl)-7,11-dihydroxy-5,9,9,10a,11a-pentamethyl-3-oxo-6a,7,8,10,10b,11-hexahydro-1H-[1]benzofuro[2,3-g]isochromen-10-yl]acetate

Formula: C29H36O10  |  Mol. Weight: 544.60 g/mol

IUPAC: methyl 2-[(1S,6aR,7R,8S,10S,10aS,10bS,11S,11aS)-8-acetyloxy-1-(furan-3-yl)-7,11-dihydroxy-5,9,9,10a,11a-pentamethyl-3-oxo-6a,7,8,10,10b,11-hexahydro-1H-[1]benzofuro[2,3-g]isochromen-10-yl]acetate

Overview

Molecular Formula C29H36O10
Molecular Weight 544.60 g/mol
Canonical SMILES CC1=C2C(C(C3(C1=CC(=O)OC3C4=COC=C4)C)O)C5(C(C(C(C(C5O2)O)OC(=O)C)(C)C)CC(=O)OC)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy