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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031570

(1S,4aS,10aR)-7-(2-hydroxypropan-2-yl)-1-(2-methoxy-2-oxoethyl)-4a-methyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

Formula: C22H30O5  |  Mol. Weight: 374.50 g/mol

IUPAC: (1S,4aS,10aR)-7-(2-hydroxypropan-2-yl)-1-(2-methoxy-2-oxoethyl)-4a-methyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

Overview

Molecular Formula C22H30O5
Molecular Weight 374.50 g/mol
Canonical SMILES CC12CCCC(C1CCC3=C2C=CC(=C3)C(C)(C)O)(CC(=O)OC)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy