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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002294

[(1S,4R,5R,6R,7S,8R,11R,13S,14R,16S,17S,18S,19R)-4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadecan-8-yl] 2-methylpentanoate

Formula: C26H40O9  |  Mol. Weight: 496.60 g/mol

IUPAC: [(1S,4R,5R,6R,7S,8R,11R,13S,14R,16S,17S,18S,19R)-4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadecan-8-yl] 2-methylpentanoate

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Overview

Molecular Formula C26H40O9
Molecular Weight 496.60 g/mol
Canonical SMILES CCCC(C)C(=O)OC1C2C(C(C3(C4C2(CO3)C(CC5C4(C(C(CC5C)O)O)C)OC1=O)O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy