Glycoside
GD124627
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)phenoxy]oxane-3,4,5-triolFormula:
C25H38O16Smiles:
OCC1OC(OCCc2ccc(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)cc2)C(O)C(O)C1OAglycone:
OCCc1ccc(O)cc1Sugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.76 |
| AlogP: | -5.31 | Num_rotatable_bonds: | 11 |
| MolWt: | 594.56 | Num_heavy_atoms: | 41 |
| TPSA: | 257.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD03863
Formula: C8H10O2
Smiles:
OCCc1ccc(O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 2 |
| MolWt: | 138.17 | Num_heavy_atoms: | 10 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
