Glycoside
GD081331
Name:
NoneFormula:
C18H23O7N5Smiles:
O=C(C(=O)N1CCCn2c(nc(Cn3ccnc3)cc2=O)C1)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
O=c1cc(Cn2ccnc2)nc2n1CCCNC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -3.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 421.41 | Num_heavy_atoms: | 30 |
| TPSA: | 171.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD36648
Formula: C12H15ON5
Smiles:
O=c1cc(Cn2ccnc2)nc2n1CCCNC2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.42 |
| AlogP: | -0.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 245.29 | Num_heavy_atoms: | 18 |
| TPSA: | 64.74 | NumAromaticRings: | 2 |
