Glycoside
GD009516
Name:
NoneFormula:
C15H21O4N7Smiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NC4CCC4)nc(N)nc32)[C@H](O)[C@H]1OAglycone:
Nc1nc2c(c(NC3CCC3)n1)N=C[N]2Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.6 |
| AlogP: | -1.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 363.38 | Num_heavy_atoms: | 26 |
| TPSA: | 160.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD07454
Formula: C9H11N6
Smiles:
Nc1nc2c(c(NC3CCC3)n1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 2 |
| MolWt: | 203.23 | Num_heavy_atoms: | 15 |
| TPSA: | 90.29 | NumAromaticRings: | 1 |
