Glycoside
GD003090
Name:
NoneFormula:
C19H28O6N6Smiles:
CC(C)=CC(=O)NCCOCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CC(C)=CC(=O)NCCOCCNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 10 |
| MolWt: | 436.47 | Num_heavy_atoms: | 31 |
| TPSA: | 163.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD02846
Formula: C14H19O2N6
Smiles:
CC(C)=CC(=O)NCCOCCNc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 8 |
| MolWt: | 303.35 | Num_heavy_atoms: | 22 |
| TPSA: | 102.6 | NumAromaticRings: | 1 |
