Glycoside
GD150936
Name:
Gynoside DFormula:
C41H70O14Smiles:
CC(C)(O)C1OC(C)(C2CCC3(C)C2C(O)CC2C4(C)CCC(OC5OCC(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC23C)CC1OAglycone:
CC(C)(O)C1OC(C)(C2CCC3(C)C2C(O)CC2C4(C)CCC(O)C(C)(C)C4CCC23C)CC1OSugarmoiety:
OCC1OC(OC2C(O)OCC(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 9 | FractionCSP3: | 1.0 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 7 |
| MolWt: | 787.0 | Num_heavy_atoms: | 55 |
| TPSA: | 228.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD48650
Formula: C30H52O5
Smiles:
CC(C)(O)C1OC(C)(C2CCC3(C)C2C(O)CC2C4(C)CCC(O)C(C)(C)C4CCC23C)CC1O| HBA: | 5 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 4.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 492.74 | Num_heavy_atoms: | 35 |
| TPSA: | 90.15 | NumAromaticRings: | 0 |
