Structure

InChI Key BLUAFEHZUWYNDE-DKGJTOOQSA-N
Smiles C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4
InChI
InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14+,15-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H22O5
Molecular Weight 282.34
AlogP 2.39
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 0.0
Polar Surface Area 53.99
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 20.0

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL567597
FDA SRS 9RMU91N5K2
Guide to Pharmacology 9954
PubChem 68827
SureChEMBL SCHEMBL60303
ZINC ZINC000100014791