Glycoside
GD049479
Name:
NoneFormula:
C11H19O6N5Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)Cn2cnnn2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(Cn1cnnn1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | -3.37 | Num_rotatable_bonds: | 6 |
| MolWt: | 317.3 | Num_heavy_atoms: | 22 |
| TPSA: | 151.85 | NumAromaticRings: | 1 |
Unique Aglycone
AD26195
Formula: C5H9O2N5
Smiles:
O=C(Cn1cnnn1)NCCO| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | -2.22 | Num_rotatable_bonds: | 4 |
| MolWt: | 171.16 | Num_heavy_atoms: | 12 |
| TPSA: | 92.93 | NumAromaticRings: | 1 |
