Glycoside
GD034725
Name:
NoneFormula:
C30H50O10Smiles:
C[C@H](CCC(=O)O)[C@@H]1CC[C@@H]2[C@@H]3[C@H](C[C@H](O)[C@@]12C)[C@]1(C)CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C[C@H]1C[C@H]3OAglycone:
CC(CCC(=O)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.97 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 570.72 | Num_heavy_atoms: | 40 |
| TPSA: | 177.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD22043
Formula: C24H40O5
Smiles:
CC(CCC(=O)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C| HBA: | 5 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.96 |
| AlogP: | 3.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 408.58 | Num_heavy_atoms: | 29 |
| TPSA: | 97.99 | NumAromaticRings: | 0 |
