Glycoside
GD020950
Name:
NoneFormula:
C18H21O6N9Smiles:
COc1ccccc1NC(=O)N=NNc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
COc1ccccc1NC(=O)N=NNc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 459.42 | Num_heavy_atoms: | 33 |
| TPSA: | 214.62 | NumAromaticRings: | 3 |
Unique Aglycone
AD14381
Formula: C13H12O2N9
Smiles:
COc1ccccc1NC(=O)N=NNc1nc(N)c2c(n1)[N]C=N2| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.08 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 326.3 | Num_heavy_atoms: | 24 |
| TPSA: | 153.34 | NumAromaticRings: | 2 |
