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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012523

Arabinothalictoside

Formula: C19H27NO12  |  Mol. Weight: 461.40 g/mol

IUPAC: (2S,3R,4S,5S,6R)-2-[4-(2-nitroethyl)phenoxy]-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol

Overview

Molecular Formula C19H27NO12
Molecular Weight 461.40 g/mol
Canonical SMILES C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC=C(C=C3)CC[N+](=O)[O-])O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy