1,5-ANHYDRO-2-DEOXY-D-LYXO-HEX-1-ENITOL

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Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key YVECGMZCTULTIS-HSUXUTPPSA-N
Smiles OC[C@H]1OC=C[C@@H](O)[C@H]1O
InChI
InChI=1/C6H10O4/c7-3-5-6(9)4(8)1-2-10-5/h1-2,4-9H,3H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10O4
Molecular Weight 146.06
AlogP -1.39
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 1.0
Polar Surface Area 69.92
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 21193-75-9
NORMAN SUSDAT
CONTENTS