(2R,3S,4R,5R)-6-{[2-(dimethylammonio)acetyl]oxy}-2,3,4,5-tetrahydroxyhexanoate

AlkaPlorer ID: AK080259

Synonym: None

IUPAC Name: (2R,3S,4R,5R)-6-[2-(dimethylamino)acetyl]oxy-2,3,4,5-tetrahydroxyhexanoic acid

Structure

SMILES: CN(C)CC(=O)OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)O

copy

InChI: InChI=1S/C10H19NO8/c1-11(2)3-6(13)19-4-5(12)7(14)8(15)9(16)10(17)18/h5,7-9,12,14-16H,3-4H2,1-2H3,(H,17,18)/t5-,7-,8+,9-/m1/s1

copy

InChIKey: ZQTHOIGMSJMBLM-BUJSFMDZSA-N

copy

Reference

PubChem CID: 45934203

CAS: 11006-56-7

SuperNatural Ⅲ: SN0477773-01

NPASS: NPC190742

Properties Information

Molecule Weight: 281.261

TPSA: 147.76

MolLogP: -3.380599999999997

Number of H-Donors: 5

Number of H-Acceptors: 8

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information