Ingredients

Reiniose f

C40H52O24

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: Reiniose f
Molecular Formula: C40H52O24
Molecular Weight: No data
Canonical SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)OC(=O)C=CC4=CC(=C(C(=C4)OC)O)OC)CO)O)OC5C(C(C(C(O5)CO)O)O)O)O
Isomeric SMILES: COC1=CC(=CC(=C1O)OC)/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)OC(=O)/C=C/C4=CC(=C(C(=C4)OC)O)OC)CO)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O
InChI: InChI=1S/C40H52O24/c1-54-19-9-17(10-20(55-2)28(19)46)5-7-26(44)58-15-25-31(49)36(62-38-34(52)33(51)30(48)23(13-41)59-38)35(53)39(60-25)64-40(16-43)37(32(50)24(14-42)63-40)61-27(45)8-6-18-11-21(56-3)29(47)22(12-18)57-4/h5-12,23-25,30-39,41-43,46-53H,13-16H2,1-4H3/b7-5+,8-6+/t23-,24-,25-,30-,31-,32-,33+,34-,35-,36+,37+,38+,39-,40+/m1/s1
Oral Bioavailability: No data
Drug Likeness: 0.051
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data