Glycoside
GD107201
Name:
NoneFormula:
C28H44O10Smiles:
COC(=O)[C@@H]1O[C@H](OCC(=O)[C@]2(O)CC[C@@H]3[C@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@@H]4CC[C@@]32C)[C@H](O)[C@H](O)[C@@H]1OAglycone:
CC12CCC(O)CC1CCC1C2CCC2(C)C1CCC2(O)C(=O)COSugarmoiety:
COC(=O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 540.65 | Num_heavy_atoms: | 38 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD44291
Formula: C21H34O4
Smiles:
CC12CCC(O)CC1CCC1C2CCC2(C)C1CCC2(O)C(=O)CO| HBA: | 4 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.95 |
| AlogP: | 2.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 350.5 | Num_heavy_atoms: | 25 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
