Glycoside
GD020705
Name:
NoneFormula:
C35H61O10NSSmiles:
CCCCCCCCCCCCC=CC(O)C(CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](S(=O)(=O)O)[C@H]1O)NC(=O)CC12CC3CC(CC(C3)C1)C2Aglycone:
CCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CC12CC3CC(CC(C3)C1)C2Sugarmoiety:
O=S(=O)(O)C1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.91 |
| AlogP: | 4.02 | Num_rotatable_bonds: | 21 |
| MolWt: | 687.94 | Num_heavy_atoms: | 47 |
| TPSA: | 182.85 | NumAromaticRings: | 0 |
Unique Aglycone
AD14257
Formula: C29H51O3N
Smiles:
CCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CC12CC3CC(CC(C3)C1)C2| HBA: | 4 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 6.3 | Num_rotatable_bonds: | 17 |
| MolWt: | 461.73 | Num_heavy_atoms: | 33 |
| TPSA: | 69.56 | NumAromaticRings: | 0 |
