Glycoside
GD141372
Name:
2-{[3,6-bis(2H-1,3-benzodioxol-5-yl)-hexahydrofuro[3,4-c]furan-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H28O12Smiles:
OCC1OC(OC2OC(c3ccc4c(c3)OCO4)C3COC(c4ccc5c(c4)OCO5)C23)C(O)C(O)C1OAglycone:
OC1OC(c2ccc3c(c2)OCO3)C2COC(c3ccc4c(c3)OCO4)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 7 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 532.5 | Num_heavy_atoms: | 38 |
| TPSA: | 154.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD56960
Formula: C20H18O7
Smiles:
OC1OC(c2ccc3c(c2)OCO3)C2COC(c3ccc4c(c3)OCO4)C12| HBA: | 7 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 2.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 370.36 | Num_heavy_atoms: | 27 |
| TPSA: | 75.61 | NumAromaticRings: | 2 |
