Glycoside
GD141370
Name:
2-({[3-hydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[4-(4-hydroxyphenyl)butan-2-yl]oxy}oxane-3,4,5-triolFormula:
C21H32O10Smiles:
CC(CCc1ccc(O)cc1)OC1OC(COC2OCC(CO)C2O)C(O)C(O)C1OAglycone:
CC(O)CCc1ccc(O)cc1Sugarmoiety:
OCC1COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 9 |
| MolWt: | 444.48 | Num_heavy_atoms: | 31 |
| TPSA: | 158.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD04221
Formula: C10H14O2
Smiles:
CC(O)CCc1ccc(O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 166.22 | Num_heavy_atoms: | 12 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
