Ingredients

Shinjulactone a

C20H26O7

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: Shinjulactone a
Molecular Formula: C20H26O7
Molecular Weight: No data
Canonical SMILES: CC1=CC(C(C2(C1CC3C45C2C(C(C(=C)C4CC(=O)O3)O)(OC5)O)C)O)O
Isomeric SMILES: CC1=C[C@@H]([C@H]([C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@]([C@@H](C(=C)[C@@H]4CC(=O)O3)O)(OC5)O)C)O)O
InChI: InChI=1S/C20H26O7/c1-8-4-12(21)16(24)18(3)10(8)5-13-19-7-26-20(25,17(18)19)15(23)9(2)11(19)6-14(22)27-13/h4,10-13,15-17,21,23-25H,2,5-7H2,1,3H3/t10-,11-,12-,13+,15+,16+,17+,18+,19+,20-/m0/s1
Oral Bioavailability: 17.448
Drug Likeness: 0.343
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data