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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034595

[(2S,3R,4S,5S,6R)-2-[[(3R,3aR,5S,9Z)-5-methyl-8-oxo-3-propan-2-yl-2,3,3a,4,6,7-hexahydro-1H-cyclopenta[8]annulen-5-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate

Formula: C30H40O8  |  Mol. Weight: 528.60 g/mol

IUPAC: [(2S,3R,4S,5S,6R)-2-[[(3R,3aR,5S,9Z)-5-methyl-8-oxo-3-propan-2-yl-2,3,3a,4,6,7-hexahydro-1H-cyclopenta[8]annulen-5-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate

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Overview

Molecular Formula C30H40O8
Molecular Weight 528.60 g/mol
Canonical SMILES CC(C)C1CCC2=CC(=O)CCC(CC12)(C)OC3C(C(C(C(O3)CO)O)O)OC(=O)C=CC4=CC=CC=C4

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy