Glycoside
GD150676
Name:
2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxan-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C18H26O12Smiles:
OCC1OC(OC2C(O)C(CO)OC(Oc3ccc(O)cc3)C2O)C(O)C(O)C1OAglycone:
Oc1ccc(O)cc1Sugarmoiety:
OCC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.67 |
| AlogP: | -3.6 | Num_rotatable_bonds: | 6 |
| MolWt: | 434.39 | Num_heavy_atoms: | 30 |
| TPSA: | 198.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD00519
Formula: C6H6O2
Smiles:
Oc1ccc(O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 0 |
| MolWt: | 110.11 | Num_heavy_atoms: | 8 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
