ALPHA-D-GALACTURONIC ACID

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII CEP8I6411H
EPA CompTox DTXSID60873878

Structure

InChI Key AEMOLEFTQBMNLQ-BKBMJHBISA-N
Smiles O=C(O)[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O
InChI
InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2+,3+,4-,6-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10O7
Molecular Weight 194.04
AlogP -3.13
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 1.0
Polar Surface Area 127.45
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 6294-16-2
NORMAN SUSDAT
FDA SRS CEP8I6411H
PubChem 445929
CONTENTS