Glycoside
GD098413
Name:
NoneFormula:
C21H29O8N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)CCCC(=O)N2CC(=O)Nc3ccccc32)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CCCC(=O)N1CC(=O)Nc2ccccc21)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 8 |
| MolWt: | 451.48 | Num_heavy_atoms: | 32 |
| TPSA: | 157.66 | NumAromaticRings: | 1 |
Unique Aglycone
AD41855
Formula: C15H19O4N3
Smiles:
O=C(CCCC(=O)N1CC(=O)Nc2ccccc21)NCCO| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 6 |
| MolWt: | 305.33 | Num_heavy_atoms: | 22 |
| TPSA: | 98.74 | NumAromaticRings: | 1 |
