Glycoside
GD056234
Name:
NoneFormula:
C15H22O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccn(C)c(=O)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Cn1ccc(C(=O)NCCO)cc1=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -2.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 342.35 | Num_heavy_atoms: | 24 |
| TPSA: | 130.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD28292
Formula: C9H12O3N2
Smiles:
Cn1ccc(C(=O)NCCO)cc1=O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 196.21 | Num_heavy_atoms: | 14 |
| TPSA: | 71.33 | NumAromaticRings: | 1 |
