Glycoside
GD084620
Name:
NoneFormula:
C17H20O8N4Smiles:
COc1ccccc1OC(=O)Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COc1ccccc1OC(=O)NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 6 |
| MolWt: | 408.37 | Num_heavy_atoms: | 29 |
| TPSA: | 178.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD37818
Formula: C12H11O4N4
Smiles:
COc1ccccc1OC(=O)NC1=C(C(N)=O)N=C[N]1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 275.24 | Num_heavy_atoms: | 20 |
| TPSA: | 117.11 | NumAromaticRings: | 1 |
