4-O-beta-D-Glucopyranosylfagomine

AlkaPlorer ID: AK089614

Synonym: ''

IUPAC Name: (2S,3R,4S,5R,6R)-2-[(2R,3R,4R)-4-hydroxy-2-(hydroxymethyl)piperidin-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Structure

SMILES: OC[C@H]1NCC[C@@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

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InChI: InChI=1S/C12H23NO8/c14-3-5-11(6(16)1-2-13-5)21-12-10(19)9(18)8(17)7(4-15)20-12/h5-19H,1-4H2/t5-,6-,7-,8+,9+,10-,11-,12-/m1/s1

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InChIKey: SBRQYNWRPMAGGE-SDBMFUTPSA-N

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Source

Properties Information

Molecule Weight: 309.315

TPSA: 151.87

MolLogP: -4.113399999999996

Number of H-Donors: 7

Number of H-Acceptors: 9

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information