Glycoside
GD018149
Name:
NoneFormula:
C14H16O6N4Smiles:
C#C[C@@]1(O)[C@H](CO)O[C@H](n2cnc3c(OC)nc(OC)nc32)[C@H]1OAglycone:
COc1nc2c(c(OC)n1)N=C[N]2Sugarmoiety:
C#CC1(O)C(CO)OC(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 336.3 | Num_heavy_atoms: | 24 |
| TPSA: | 131.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD12856
Formula: C7H7O2N4
Smiles:
COc1nc2c(c(OC)n1)N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 2 |
| MolWt: | 179.16 | Num_heavy_atoms: | 13 |
| TPSA: | 70.7 | NumAromaticRings: | 1 |
