Molecular Identity
Fagomine
(2R,3R,4R)-2-(hydroxymethyl)piperidine-3,4-diol
PubChem CID: 72259
Fagomine is a member of piperidines.
2D Structure
Properties
C6H13NO3
Molecular Formula
147.17
Molecular Weight
g/mol
147.0895
Exact Mass
Da
-1.4
XLogP
Drug-like (Lipinski: < 5)
72.7
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
4
H-Bond Acceptors
109
Complexity
SMILES
Canonical SMILES
SMILES: C1CNC(C(C1O)O)COIsomeric SMILES
SMILES: C1CN[C@@H]([C@H]([C@@H]1O)O)COSynonyms(20)
Fagomine53185-12-9D-Fagomine(2r,3r,4r)-2-(hydroxymethyl)piperidine-3,4-diol1,2,5-Trideoxy-1,5-imino-D-arabino-hexitol1M10C1P4SMDTXSID10201243D-arabino-Hexitol, 1,2,5-trideoxy-1,5-imino-RefChem:139877DTXCID101237343,4-Piperidinediol, 2-(hydroxymethyl)-, (2R,3R,4R)-CHEMBL108084(2R,3R,4R)-2-(Hydroxymethyl)-3,4-piperidinediolFAGUNII-1M10C1P4SM
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Fagomine
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