Glycoside
GD032702
Name:
NoneFormula:
C28H39O10FSmiles:
C[C@@H]1CC2C3CCC4=CC(=O)C=CC4(C)[C@@]3(F)C(O)CC2(C)[C@@]1(O)C(=O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
CC1CC2C3CCC4=CC(=O)C=CC4(C)C3(F)C(O)CC2(C)C1(O)C(=O)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.79 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 554.61 | Num_heavy_atoms: | 39 |
| TPSA: | 173.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD14860
Formula: C22H29O5F
Smiles:
CC1CC2C3CCC4=CC(=O)C=CC4(C)C3(F)C(O)CC2(C)C1(O)C(=O)CO| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.73 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 392.47 | Num_heavy_atoms: | 28 |
| TPSA: | 94.83 | NumAromaticRings: | 0 |
