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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005306

Bisdehydroneotuberostemonine

Formula: C22H29NO4  |  Mol. Weight: 371.50 g/mol

IUPAC: (9R,10R,11R,14S,15S)-10-ethyl-14-methyl-3-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]-12-oxa-4-azatetracyclo[7.6.1.04,16.011,15]hexadeca-1(16),2-dien-13-one

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Overview

Molecular Formula C22H29NO4
Molecular Weight 371.50 g/mol
Canonical SMILES CCC1C2CCCCN3C2=C(C=C3C4CC(C(=O)O4)C)C5C1OC(=O)C5C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy