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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016271

O-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] N-[[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]carbamothioate

Formula: C20H29NO11S  |  Mol. Weight: 491.50 g/mol

IUPAC: O-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] N-[[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]carbamothioate

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Overview

Molecular Formula C20H29NO11S
Molecular Weight 491.50 g/mol
Canonical SMILES CC1C(C(C(C(O1)OC2=CC=C(C=C2)CNC(=S)OC3C(C(C(C(O3)CO)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy