Glycoside
GD027024
Name:
A 31438Formula:
C28H50O10Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(O)[C@H](O)[C@H](C)O2)[C@H](C)[C@H](O)[C@@](C)(O)C[C@H](C)C(=O)[C@H](C)[C@H](O)[C@H]1CAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(O)C(C)(O)CC(C)C(=O)C(C)C(O)C1CSugarmoiety:
CC1OC(O)CC(C)(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 546.7 | Num_heavy_atoms: | 38 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD13313
Formula: C21H38O7
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(O)C(C)(O)CC(C)C(=O)C(C)C(O)C1C| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 402.53 | Num_heavy_atoms: | 28 |
| TPSA: | 124.29 | NumAromaticRings: | 0 |
