Glycoside
GD033484
Name:
NoneFormula:
C21H24O4N6Smiles:
C[C@@H]1O[C@H](n2nc(-c3ccccc3)c3c(NCC(=O)NC4CC4)ncnc32)[C@H](O)[C@H]1OAglycone:
O=C(CNc1ncnc2c1C(c1ccccc1)=N[N]2)NC1CC1Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 424.46 | Num_heavy_atoms: | 31 |
| TPSA: | 134.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD11526
Formula: C16H15ON6
Smiles:
O=C(CNc1ncnc2c1C(c1ccccc1)=N[N]2)NC1CC1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 5 |
| MolWt: | 307.34 | Num_heavy_atoms: | 23 |
| TPSA: | 93.37 | NumAromaticRings: | 2 |
