Glycoside
GD042776
Name:
NoneFormula:
C13H19O5N3Smiles:
O=c1nc(N2CCCC2)ccn1[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1OAglycone:
O=c1nc(N2CCCC2)cc[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.69 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 3 |
| MolWt: | 297.31 | Num_heavy_atoms: | 21 |
| TPSA: | 108.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD24872
Formula: C8H11ON3
Smiles:
O=c1nc(N2CCCC2)cc[nH]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 1 |
| MolWt: | 165.2 | Num_heavy_atoms: | 12 |
| TPSA: | 48.99 | NumAromaticRings: | 1 |
