Glycoside
GD140493
Name:
Pteroside UFormula:
C20H28O10Smiles:
CC1C(=O)c2c(cc(CO)c(CCOC3OC(CO)C(O)C(O)C3O)c2CO)C1OAglycone:
CC1C(=O)c2c(cc(CO)c(CCO)c2CO)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.65 |
| AlogP: | -2.1 | Num_rotatable_bonds: | 7 |
| MolWt: | 428.43 | Num_heavy_atoms: | 30 |
| TPSA: | 177.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD56648
Formula: C14H18O5
Smiles:
CC1C(=O)c2c(cc(CO)c(CCO)c2CO)C1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 266.29 | Num_heavy_atoms: | 19 |
| TPSA: | 97.99 | NumAromaticRings: | 1 |
