Glycoside
GD150272
Name:
2-(3,4-dihydroxyphenyl)-8-hydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}-hexahydro-2H-pyrano[2,3-b][1,4]dioxin-7-yl 3-(3,4-dihydroxyphenyl)prop-2-enoateFormula:
C28H32O15Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC1C(COC2OCC(O)C(O)C2O)OC2OCC(c3ccc(O)c(O)c3)OC2C1OAglycone:
O=C(C=Cc1ccc(O)c(O)c1)OC1C(CO)OC2OCC(c3ccc(O)c(O)c3)OC2C1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.46 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 7 |
| MolWt: | 608.55 | Num_heavy_atoms: | 43 |
| TPSA: | 234.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD03256
Formula: C23H24O11
Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC1C(CO)OC2OCC(c3ccc(O)c(O)c3)OC2C1O| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 476.43 | Num_heavy_atoms: | 34 |
| TPSA: | 175.37 | NumAromaticRings: | 2 |
