Ingredients

Dimethyllithospermate

C29H26O12

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: Dimethyllithospermate
Molecular Formula: C29H26O12
Molecular Weight: No data
Canonical SMILES: COC(=O)C1C(OC2=C(C=CC(=C12)C=CC(=O)OC(CC3=CC(=C(C=C3)O)O)C(=O)OC)O)C4=CC(=C(C=C4)O)O
Isomeric SMILES: COC(=O)[C@@H]1[C@H](OC2=C(C=CC(=C12)/C=C/C(=O)O[C@H](CC3=CC(=C(C=C3)O)O)C(=O)OC)O)C4=CC(=C(C=C4)O)O
InChI: InChI=1S/C29H26O12/c1-38-28(36)22(12-14-3-7-17(30)20(33)11-14)40-23(35)10-6-15-4-9-19(32)27-24(15)25(29(37)39-2)26(41-27)16-5-8-18(31)21(34)13-16/h3-11,13,22,25-26,30-34H,12H2,1-2H3/b10-6+/t22-,25+,26-/m1/s1
Oral Bioavailability: 2.661
Drug Likeness: 0.116
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data