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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005525

(1S,2R,5S,6S,7R,9R,11R,12R,14S,16R,17R)-5,6-dihydroxy-16-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,17-dimethyl-8,13-dioxahexacyclo[9.8.0.02,7.07,9.012,14.012,17]nonadecan-3-one

Formula: C28H38O8  |  Mol. Weight: 502.60 g/mol

IUPAC: (1S,2R,5S,6S,7R,9R,11R,12R,14S,16R,17R)-5,6-dihydroxy-16-[(1S)-1-[(2R)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,17-dimethyl-8,13-dioxahexacyclo[9.8.0.02,7.07,9.012,14.012,17]nonadecan-3-one

Overview

Molecular Formula C28H38O8
Molecular Weight 502.60 g/mol
Canonical SMILES CC1=C(C(=O)OC(C1)C(C)C2CC3C4(C2(CCC5C4CC6C7(C5(C(=O)CC(C7O)O)C)O6)C)O3)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy