Glycoside
GD135221
Name:
2-{[3,4,5-trihydroxy-6-({3,4,5-trihydroxy-6-[(3-phenylprop-2-en-1-yl)oxy]oxan-2-yl}methoxy)oxan-2-yl]methoxy}oxane-2,3,4,5-tetrolFormula:
C26H38O16Smiles:
OC1COC(O)(OCC2OC(OCC3OC(OCC=Cc4ccccc4)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C1OAglycone:
OCC=Cc1ccccc1Sugarmoiety:
OC1COC(O)(OCC2OC(OCC3OC(O)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.69 |
| AlogP: | -4.88 | Num_rotatable_bonds: | 10 |
| MolWt: | 606.57 | Num_heavy_atoms: | 42 |
| TPSA: | 257.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD05536
Formula: C9H10O
Smiles:
OCC=Cc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 2 |
| MolWt: | 134.18 | Num_heavy_atoms: | 10 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
