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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013411

Citrifolinin b epimer b

Formula: C17H22O12  |  Mol. Weight: 418.30 g/mol

IUPAC: methyl (2S,3'S,4S,5R,7S)-3'-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[3,8-dioxatricyclo[4.4.0.02,4]dec-9-ene-5,2'-oxirane]-10-carboxylate

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Overview

Molecular Formula C17H22O12
Molecular Weight 418.30 g/mol
Canonical SMILES COC(=O)C1=COC(C2C1C3C(C24C(O4)O)O3)OC5C(C(C(C(O5)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy