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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP028300

[(3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-4-hydroxy-2-[[(E)-2-(hydroxymethyl)but-2-enoyl]oxymethyl]but-2-enoate

Formula: C25H32O8  |  Mol. Weight: 460.50 g/mol

IUPAC: [(3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-4-hydroxy-2-[[(E)-2-(hydroxymethyl)but-2-enoyl]oxymethyl]but-2-enoate

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Overview

Molecular Formula C25H32O8
Molecular Weight 460.50 g/mol
Canonical SMILES CC=C(CO)C(=O)OCC(=CCO)C(=O)OC1CC(=CCCC(=CC2C1C(=C)C(=O)O2)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy