Structure

InChI Key UXYRZJKIQKRJCF-TZPFWLJSSA-N
Smile C[C@H]1CC(=O)C[C@@H]2CC[C@H]3[C@@H]4CC[C@H](O)[C@@]4(C)CC[C@@H]3[C@@]12C
InChI
InChI=1S/C20H32O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h12-13,15-18,22H,4-11H2,1-3H3/t12-,13-,15-,16-,17-,18-,19-,20-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H32O2
Molecular Weight 304.47
AlogP 4.21
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 37.3
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 22.0

Pharmacology

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 135293
ChEMBL CHEMBL258918
DrugBank DB13587
DrugCentral 3342
EPA CompTox DTXSID90878533
FDA SRS 0SRQ75X9I9
Human Metabolome Database HMDB0006036
PubChem 15020
SureChEMBL SCHEMBL148260
ZINC ZINC000003881977