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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038230

[(1S,4R,5R,6S,8R,9S,10S,13S,14R,15S,17R,19R,22R)-14-formyl-10,17-dimethyl-9-(6-oxopyran-3-yl)-7,16,18,21-tetraoxaheptacyclo[15.3.1.115,19.01,14.04,13.05,10.06,8]docosan-22-yl] acetate

Formula: C28H32O9  |  Mol. Weight: 512.50 g/mol

IUPAC: [(1S,4R,5R,6S,8R,9S,10S,13S,14R,15S,17R,19R,22R)-14-formyl-10,17-dimethyl-9-(6-oxopyran-3-yl)-7,16,18,21-tetraoxaheptacyclo[15.3.1.115,19.01,14.04,13.05,10.06,8]docosan-22-yl] acetate

Overview

Molecular Formula C28H32O9
Molecular Weight 512.50 g/mol
Canonical SMILES CC(=O)OC1C2CC34CCC5C(C3(C1OC(O2)(O4)C)C=O)CCC6(C5C7C(C6C8=COC(=O)C=C8)O7)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy