Glycoside
GD131826
Name:
Safghanoside CFormula:
C30H40O17Smiles:
CC=C1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OCCc2ccc(O)cc2)C1CC(=O)OC1OC(CO)C(O)C(O)C1OAglycone:
CC=C1C(O)OC=C(C(=O)OCCc2ccc(O)cc2)C1CC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.6 |
| AlogP: | -3.17 | Num_rotatable_bonds: | 11 |
| MolWt: | 672.63 | Num_heavy_atoms: | 47 |
| TPSA: | 271.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD47914
Formula: C18H20O7
Smiles:
CC=C1C(O)OC=C(C(=O)OCCc2ccc(O)cc2)C1CC(=O)O| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 348.35 | Num_heavy_atoms: | 25 |
| TPSA: | 113.29 | NumAromaticRings: | 1 |
