6-Phosphogluconic Acid

6-Phosphogluconic Acid bmse000198 - Data bmst000165 - Theory

6_phosphogluconic_acid synonyms

D-Gluconic acid 6-(dihydrogen phosphate); 6-Phospho-D-gluconate; 6-Phosphogluconate; Gluconic acid-6-phosphate

Wikipedia:

Graphical representations:

6_phosphogluconic_acid

View large 3D structure

Molecular Formula: C6H13O10P

Natural Isotopic Abundance Mass: 276.1351810000

Mono-Isotopic Molecular Masses:

  • C12N14: 276.024633148
  • C13N14: 282.044762175
  • C12N15: 276.024633148
  • C13N15: 282.044762175

InChI string: InChI=1/C6H13O10P/c7-2(1-16-17(13,14)15)3(8)4(9)5(10)6(11)12/h2-5,7-10H,1H2,(H,11,12)(H2,13,14,15)/t2-,3-,4+,5-/m1/s1/f/h11,13-14H

IUPAC: (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-phosphonooxy-hexanoic acid

PubChem Compound (CID): 91493
KEGG Compound ID: C00345
CAS Registry number: 2464-13-3 921-62-0
ChEBI: 16863
EINECS: 213-069-9

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)