Glycoside
GD130287
Name:
2-{[1,7-bis(4-hydroxyphenyl)heptan-3-yl]oxy}oxane-3,4,5-triolFormula:
C24H32O7Smiles:
Oc1ccc(CCCCC(CCc2ccc(O)cc2)OC2OCC(O)C(O)C2O)cc1Aglycone:
Oc1ccc(CCCCC(O)CCc2ccc(O)cc2)cc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 2.27 | Num_rotatable_bonds: | 10 |
| MolWt: | 432.51 | Num_heavy_atoms: | 31 |
| TPSA: | 119.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD14010
Formula: C19H24O3
Smiles:
Oc1ccc(CCCCC(O)CCc2ccc(O)cc2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.37 |
| AlogP: | 3.8 | Num_rotatable_bonds: | 8 |
| MolWt: | 300.4 | Num_heavy_atoms: | 22 |
| TPSA: | 60.69 | NumAromaticRings: | 2 |
