Glycoside
GD082419
Name:
NoneFormula:
C19H30O6N5Smiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1NC1=CC[C@@H]([NH+]2CCOCC2)CC1Aglycone:
NC(=O)C1=C(NC2=CCC([NH+]3CCOCC3)CC2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.68 |
| AlogP: | -2.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 424.48 | Num_heavy_atoms: | 30 |
| TPSA: | 156.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD37040
Formula: C14H21O2N5
Smiles:
NC(=O)C1=C(NC2=CCC([NH+]3CCOCC3)CC2)[N]C=N1| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 291.35 | Num_heavy_atoms: | 21 |
| TPSA: | 95.25 | NumAromaticRings: | 0 |
