Glycoside
GD033081
Name:
NoneFormula:
C17H23O5N5Smiles:
CCCCC#Cc1nc(NOC)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
CCCCC#Cc1nc2c(c(NOC)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 377.4 | Num_heavy_atoms: | 27 |
| TPSA: | 134.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD21142
Formula: C12H14ON5
Smiles:
CCCCC#Cc1nc2c(c(NOC)n1)N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.42 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 4 |
| MolWt: | 244.28 | Num_heavy_atoms: | 18 |
| TPSA: | 73.5 | NumAromaticRings: | 1 |
