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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP094160

Tomatidine

Formula: C27H45NO2  |  Mol. Weight: 415.70 g/mol

IUPAC: (1R,2S,4S,5'S,6S,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidine]-16-ol

Overview

Molecular Formula C27H45NO2
Molecular Weight 415.70 g/mol
Canonical SMILES CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)NC1

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Therapeutics & Targets

Disease Associations