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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026646

Betanidin radical

Formula: C18H14N2O8-2  |  Mol. Weight: 386.30 g/mol

IUPAC: (2S)-1-[(E)-2-[(2S)-6-carboxy-2-carboxylato-2,3-dihydropyridin-4-yl]ethenyl]-5,6-dihydroxy-2,3-dihydroindole-2-carboxylate

Overview

Molecular Formula C18H14N2O8-2
Molecular Weight 386.30 g/mol
Canonical SMILES C1C(N=C(C=C1C=CN2C(CC3=CC(=C(C=C32)O)O)C(=O)[O-])C(=O)O)C(=O)[O-]

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy