Glycoside
GD037445
Name:
NoneFormula:
C50H95O7NF4Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C(F)(F)C(F)(F)CCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(F)(F)C(F)(F)CCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.98 |
| AlogP: | 13.03 | Num_rotatable_bonds: | 44 |
| MolWt: | 898.3 | Num_heavy_atoms: | 62 |
| TPSA: | 128.48 | NumAromaticRings: | 0 |
Unique Aglycone
AD23588
Formula: C44H85O2NF4
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(F)(F)C(F)(F)CCCCCCCCCCCCCC| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.98 |
| AlogP: | 15.21 | Num_rotatable_bonds: | 41 |
| MolWt: | 736.16 | Num_heavy_atoms: | 51 |
| TPSA: | 49.33 | NumAromaticRings: | 0 |
