Glycoside
GD022311
Name:
NoneFormula:
C21H28O7N4Smiles:
C[C@H](N)C(=O)N1Cc2[nH]c3ccccc3c2C[C@H]1C(=O)N[C@@H]1C(O)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CC(N)C(=O)N1Cc2[nH]c3ccccc3c2CC1C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.52 |
| AlogP: | -2.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 448.48 | Num_heavy_atoms: | 32 |
| TPSA: | 181.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD15144
Formula: C15H18O2N4
Smiles:
CC(N)C(=O)N1Cc2[nH]c3ccccc3c2CC1C(N)=O| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 286.34 | Num_heavy_atoms: | 21 |
| TPSA: | 105.21 | NumAromaticRings: | 2 |
