Ingredients

Rhubarb

C61H50O30

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: Rhubarb
Molecular Formula: C61H50O30
Molecular Weight: No data
Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O.C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)O.C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O
Isomeric SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O.C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)O.C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O
InChI: InChI=1S/C27H24O18.C20H18O10.C14H8O2/c28-11-1-8(2-12(29)18(11)34)24(39)42-7-17-21(37)23(44-25(40)9-3-13(30)19(35)14(31)4-9)22(38)27(43-17)45-26(41)10-5-15(32)20(36)16(33)6-10;21-6-12-16(25)18(27)19(28)20(30-12)29-11-5-7(22)4-9-14(11)17(26)13-8(15(9)24)2-1-3-10(13)23;15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-6,17,21-23,27-38H,7H2;1-5,12,16,18-23,25,27-28H,6H2;1-8H
Oral Bioavailability: No data
Drug Likeness: 0.052
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data