(2?)-D-GLUCO-HEPTONIC ACID, POTASSIUM SALT

/static/temp/default.svg Search structure
Keyword(s): Human Metabolites
Molecule Category Salt-form

Structure

InChI Key KWMLJOLKUYYJFJ-QYESYBIKSA-N
Smiles [K+].OC[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)C(O)=O
InChI
InChI=1S/C7H14O8/c8-1-2(9)3(10)4(11)5(12)6(13)7(14)15/h2-6,8-13H,1H2,(H,14,15)/t2-,3-,4+,5-,6-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H14O8
Molecular Weight 226.07
AlogP -4.13
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 7.0
Number of Rotational Bond 6.0
Polar Surface Area 158.68
Heavy Atoms 15.0

Cross References

Resources Reference
CAS NUMBER 23167-96-6
NORMAN SUSDAT
CONTENTS