Glycoside
GD084911
Name:
NoneFormula:
C19H27O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCC4(CO)CC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OCC1(CNc2ncnc3c2N=C[N]3)CC2(CCC2)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.74 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 6 |
| MolWt: | 405.46 | Num_heavy_atoms: | 29 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD38002
Formula: C14H18ON5
Smiles:
OCC1(CNc2ncnc3c2N=C[N]3)CC2(CCC2)C1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 4 |
| MolWt: | 272.33 | Num_heavy_atoms: | 20 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
