Glycoside
GD006448
Name:
NoneFormula:
C18H19O7N3Smiles:
Cc1cc(=O)oc2cc(OCc3cn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)nn3)ccc12Aglycone:
Cc1cc(=O)oc2cc(OCC3=C[N]N=N3)ccc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.39 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 389.36 | Num_heavy_atoms: | 28 |
| TPSA: | 140.07 | NumAromaticRings: | 3 |
Unique Aglycone
AD05344
Formula: C13H10O3N3
Smiles:
Cc1cc(=O)oc2cc(OCC3=C[N]N=N3)ccc12| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.15 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.24 | Num_heavy_atoms: | 19 |
| TPSA: | 78.26 | NumAromaticRings: | 2 |
