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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009190

[(1S,4aS,6S,7R,7aS)-4-(acetyloxymethyl)-6-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate

Formula: C27H34O9  |  Mol. Weight: 502.60 g/mol

IUPAC: [(1S,4aS,6S,7R,7aS)-4-(acetyloxymethyl)-6-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl] 3-methylbutanoate

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Overview

Molecular Formula C27H34O9
Molecular Weight 502.60 g/mol
Canonical SMILES CC1C(CC2C1C(OC=C2COC(=O)C)OC(=O)CC(C)C)OC(=O)C=CC3=CC(=C(C=C3)O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy