Glycoside
GD062952
Name:
NoneFormula:
C14H21O5N6Smiles:
O=c1[nH]cnc2c1nc(N1CC[NH2+]CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
O=c1[nH]cnc2c1N=C(N1CC[NH2+]CC1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -3.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 353.36 | Num_heavy_atoms: | 25 |
| TPSA: | 153.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD30338
Formula: C9H12ON6
Smiles:
O=c1[nH]cnc2c1N=C(N1CC[NH2+]CC1)[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | -2.11 | Num_rotatable_bonds: | 0 |
| MolWt: | 220.24 | Num_heavy_atoms: | 16 |
| TPSA: | 92.06 | NumAromaticRings: | 1 |
