Glycoside
GD076999
Name:
NoneFormula:
C17H25O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCCC4(CO)CCC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OCC1(CCNc2ncnc3c2N=C[N]3)CCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 379.42 | Num_heavy_atoms: | 27 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD35360
Formula: C12H16ON5
Smiles:
OCC1(CCNc2ncnc3c2N=C[N]3)CCC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 246.29 | Num_heavy_atoms: | 18 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
