Glycoside
GD099192
Name:
NoneFormula:
C20H25O6N7Smiles:
CCCOc1ccccc1C/N=N/c1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CCCOc1ccccc1CN=NC1=Nc2c(nc(N)[nH]c2=O)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 8 |
| MolWt: | 459.46 | Num_heavy_atoms: | 33 |
| TPSA: | 193.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD42208
Formula: C15H16O2N7
Smiles:
CCCOc1ccccc1CN=NC1=Nc2c(nc(N)[nH]c2=O)[N]1| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.27 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 326.34 | Num_heavy_atoms: | 24 |
| TPSA: | 132.18 | NumAromaticRings: | 2 |
