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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006869

[(1S,5R,8R,9S,10R,11S,13R,14S,16S,17R,18S,19S)-10,13-dihydroxy-5-methyl-12-methylidene-3-oxo-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-19-yl] benzoate

Formula: C27H29NO5  |  Mol. Weight: 447.50 g/mol

IUPAC: [(1S,5R,8R,9S,10R,11S,13R,14S,16S,17R,18S,19S)-10,13-dihydroxy-5-methyl-12-methylidene-3-oxo-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-19-yl] benzoate

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Overview

Molecular Formula C27H29NO5
Molecular Weight 447.50 g/mol
Canonical SMILES CC12CC(=O)CC34C1C5CC67C3C(C(C(C6C4N5C2)O)C(=C)C7O)OC(=O)C8=CC=CC=C8

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy