Synonyms
Status
Molecule Category UNKNOWN
ATC B05AA05

Structure

InChI Key FZWBNHMXJMCXLU-BLAUPYHCSA-N
Smiles O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
InChI
InChI=1S/C18H32O16/c19-1-5(21)9(23)10(24)6(22)3-31-17-16(30)14(28)12(26)8(34-17)4-32-18-15(29)13(27)11(25)7(2-20)33-18/h1,5-18,20-30H,2-4H2/t5-,6+,7+,8+,9+,10+,11+,12+,13-,14-,15+,16+,17-,18-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H32O16
Molecular Weight 504.44
AlogP -7.73
Hydrogen Bond Acceptor 16.0
Hydrogen Bond Donor 11.0
Number of Rotational Bond 11.0
Polar Surface Area 276.52
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 34.0

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL1697742
SureChEMBL SCHEMBL206877
ZINC ZINC000064622163