Glycoside
GD001703
Name:
NoneFormula:
C30H44O8F6Smiles:
C[C@@]12CC[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)CC1=CC[C@H]1[C@H]2CC[C@@]2(C)[C@H]([C@H](O)CC(O)(C(F)(F)F)C(F)(F)F)CC[C@H]12Aglycone:
CC12CCC(O)CC1=CCC1C2CCC2(C)C(C(O)CC(O)(C(F)(F)F)C(F)(F)F)CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | 3.36 | Num_rotatable_bonds: | 6 |
| MolWt: | 646.66 | Num_heavy_atoms: | 44 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD01679
Formula: C24H34O3F6
Smiles:
CC12CCC(O)CC1=CCC1C2CCC2(C)C(C(O)CC(O)(C(F)(F)F)C(F)(F)F)CCC12| HBA: | 3 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.92 |
| AlogP: | 5.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 484.52 | Num_heavy_atoms: | 33 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
