Glycoside
GD134472
Name:
4-(benzyloxy)-6-methyl-5-{[3,4,5-tris(benzyloxy)-6-methyloxan-2-yl]oxy}-2-{[2,4,5-tris(benzyloxy)-6-methyloxan-3-yl]oxy}oxan-3-yl acetateFormula:
C69H76O14Smiles:
CC(=O)OC1C(OC2C(OCc3ccccc3)OC(C)C(OCc3ccccc3)C2OCc2ccccc2)OC(C)C(OC2OC(C)C(OCc3ccccc3)C(OCc3ccccc3)C2OCc2ccccc2)C1OCc1ccccc1Aglycone:
OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1.OCc1ccccc1Sugarmoiety:
CC(=O)OC1C(OC2C(O)OC(C)C(O)C2O)OC(C)C(OC2OC(C)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 10 |
| HBD: | 0 | FractionCSP3: | 0.38 |
| AlogP: | 11.65 | Num_rotatable_bonds: | 26 |
| MolWt: | 1129.35 | Num_heavy_atoms: | 83 |
| TPSA: | 137.06 | NumAromaticRings: | 7 |
Unique Aglycone
AD00044
Formula: C7H8O
Smiles:
OCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
