Glycoside
GD063872
Name:
NoneFormula:
C14H20O5N6Smiles:
Cc1nn(C)cc1Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1nn(C)cc1NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 352.35 | Num_heavy_atoms: | 25 |
| TPSA: | 160.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD30724
Formula: C9H11ON6
Smiles:
Cc1nn(C)cc1NC1=C(C(N)=O)N=C[N]1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 219.23 | Num_heavy_atoms: | 16 |
| TPSA: | 99.4 | NumAromaticRings: | 1 |
