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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP039126

[(2S)-2-[(1R,8S,10S)-3,4-dihydroxy-11,11-dimethyl-15-oxo-16-oxatetracyclo[6.6.2.01,10.02,7]hexadeca-2,4,6-trien-5-yl]propyl] acetate

Formula: C22H28O6  |  Mol. Weight: 388.50 g/mol

IUPAC: [(2S)-2-[(1R,8S,10S)-3,4-dihydroxy-11,11-dimethyl-15-oxo-16-oxatetracyclo[6.6.2.01,10.02,7]hexadeca-2,4,6-trien-5-yl]propyl] acetate

Overview

Molecular Formula C22H28O6
Molecular Weight 388.50 g/mol
Canonical SMILES CC(COC(=O)C)C1=C(C(=C2C(=C1)C3CC4C2(CCCC4(C)C)C(=O)O3)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy