Synonyms
Status
Molecule Category UNKNOWN
UNII 62GA3K28B6

Structure

InChI Key PEPMWUSGRKINHX-TXTPUJOMSA-N
Smiles CC1=CC(=O)C=C2CC[C@@H]3[C@H](CC[C@]4(C)C(=O)CC[C@@H]34)[C@@]12C
InChI
InChI=1S/C20H26O2/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/h10-11,15-17H,4-9H2,1-3H3/t15-,16-,17-,19-,20-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H26O2
Molecular Weight 298.43
AlogP 4.25
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 0.0
Polar Surface Area 34.14
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 22.0

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL2105987
DrugBank DB12194
FDA SRS 62GA3K28B6
PubChem 57050
SureChEMBL SCHEMBL59128
ZINC ZINC000004214890