6-O-(6-DEOXY-A-L-MANNOPYRANOSYL)-ß-D-GLUCOSE

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

Structure

InChI Key MZVJLQGKLDLTTO-NIECQZCASA-N
Smiles C[C@@H]1O[C@@H](CO[C@H]2O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChI
InChI=1S/C12H22O10/c1-3-5(13)7(15)6(14)4(21-3)2-20-12-10(18)8(16)9(17)11(19)22-12/h3-19H,2H2,1H3/t3-,4-,5-,6-,7+,8+,9+,10-,11+,12-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H22O10
Molecular Weight 326.12
AlogP -4.37
Hydrogen Bond Acceptor 10.0
Hydrogen Bond Donor 7.0
Number of Rotational Bond 3.0
Polar Surface Area 169.3
Heavy Atoms 22.0

Cross References

Resources Reference
CAS NUMBER 26184-96-3
NORMAN SUSDAT
CONTENTS