Glycoside
GD106787
Name:
NoneFormula:
C26H38O11Smiles:
C[C@]12CC[C@H](O[C@H]3O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]3O)C[C@@H]1CC[C@H]1[C@H]2C(=O)C[C@@]2(C)[C@@H]1CC[C@@]2(O)C(=O)OAglycone:
CC12CCC(O)CC1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 526.58 | Num_heavy_atoms: | 37 |
| TPSA: | 191.05 | NumAromaticRings: | 0 |
Unique Aglycone
AD44213
Formula: C20H30O5
Smiles:
CC12CCC(O)CC1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)O| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 350.46 | Num_heavy_atoms: | 25 |
| TPSA: | 94.83 | NumAromaticRings: | 0 |
