Glycoside
GD155653
Name:
NoneFormula:
C38H60O16SSmiles:
CC(C)CC1OC1C(C)C1CCC2C3CC(OS(=O)(=O)O)C4CC(OC5OC(C(=O)O)C(O)C(O)C5OC5OCC(O)C(O)C5O)CCC4(C)C3=CCC21CAglycone:
CC(C)CC1OC1C(C)C1CCC2C3CC(OS(=O)(=O)O)C4CC(O)CCC4(C)C3=CCC21CSugarmoiety:
O=C(O)C1OC(O)C(OC2OCC(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.92 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 11 |
| MolWt: | 804.95 | Num_heavy_atoms: | 55 |
| TPSA: | 251.5 | NumAromaticRings: | 0 |
Unique Aglycone
AD47126
Formula: C27H44O6S
Smiles:
CC(C)CC1OC1C(C)C1CCC2C3CC(OS(=O)(=O)O)C4CC(O)CCC4(C)C3=CCC21C| HBA: | 6 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.93 |
| AlogP: | 5.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 496.71 | Num_heavy_atoms: | 34 |
| TPSA: | 96.36 | NumAromaticRings: | 0 |
