Ingredients

Shinjulactone b

C19H22O7

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: Shinjulactone b
Molecular Formula: C19H22O7
Molecular Weight: No data
Canonical SMILES: CC1C2CC(=O)OC3C2(C(=C(C1=O)O)C(C3)(C)C4C(=CC(=O)O4)C)CO
Isomeric SMILES: CC1C2CC(=O)O[C@H]3[C@@]2(C(=C(C1=O)O)[C@@](C3)(C)[C@@H]4C(=CC(=O)O4)C)CO
InChI: InChI=1S/C19H22O7/c1-8-4-12(21)26-17(8)18(3)6-11-19(7-20)10(5-13(22)25-11)9(2)14(23)15(24)16(18)19/h4,9-11,17,20,24H,5-7H2,1-3H3/t9?,10?,11-,17+,18+,19-/m1/s1
Oral Bioavailability: 98.403
Drug Likeness: 0.711
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data