3,4-Dihydroxy-2,5-bis(hydroxymethyl)pyrrolidine; (2R,3R,4R,5R)-form, 3-O-β-D-Glucopyranoside 

AlkaPlorer ID: AK244566

Synonym: None

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

Structure

SMILES: OCC1NC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O

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InChI: InChI=1S/C12H23NO9/c14-1-4-7(17)11(5(2-15)13-4)22-12-10(20)9(19)8(18)6(3-16)21-12/h4-20H,1-3H2

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InChIKey: AZDBETUGBOOBRU-UHFFFAOYSA-N

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Reference

PubChem CID: 73030944

COCONUT: CNP0223433

Properties Information

Molecule Weight: 325.314

TPSA: 172.1

MolLogP: -5.142599999999993

Number of H-Donors: 8

Number of H-Acceptors: 10

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information