Glycoside
GD012945
Name:
NoneFormula:
C13H20O7N6Smiles:
NCC(O)Cn1c(=O)n(C2OC(CO)[C@H](O)[C@H]2O)c2nc(N)nc(O)c21Aglycone:
NCC(O)Cn1c(=O)[nH]c2nc(N)nc(O)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.62 |
| AlogP: | -4.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 372.34 | Num_heavy_atoms: | 26 |
| TPSA: | 215.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD09718
Formula: C8H12O3N6
Smiles:
NCC(O)Cn1c(=O)[nH]c2nc(N)nc(O)c21| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 240.22 | Num_heavy_atoms: | 17 |
| TPSA: | 156.07 | NumAromaticRings: | 2 |
