(2S)-2-ammonio-3-(4-oxo-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pyridin-1-yl)propanoate

AlkaPlorer ID: AK091678

Synonym: None

IUPAC Name: 2-amino-3-[4-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypyridin-1-yl]propanoic acid

Structure

SMILES: NC(CN1C=CC(=O)C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C1)C(=O)O

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InChI: InChI=1S/C14H20N2O9/c15-6(13(22)23)3-16-2-1-7(18)8(4-16)24-14-12(21)11(20)10(19)9(5-17)25-14/h1-2,4,6,9-12,14,17,19-21H,3,5,15H2,(H,22,23)/t6?,9-,10-,11+,12-,14-/m1/s1

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InChIKey: YPZZVPSBAOOJGU-SNXQMOOZSA-N

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Reference

PubChem CID: 5319840

NPASS: NPC138065

Properties Information

Molecule Weight: 360.319

TPSA: 184.7

MolLogP: -3.561099999999998

Number of H-Donors: 6

Number of H-Acceptors: 10

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information