Glycoside
GD012275
Name:
NoneFormula:
C17H23O5N5Smiles:
OC[C@@H]1OC(n2cnc3c(NC4CC5CCC4C5)nc(O)nc32)[C@H](O)[C@H]1OAglycone:
Oc1nc2c(c(NC3CC4CCC3C4)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 377.4 | Num_heavy_atoms: | 27 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD09272
Formula: C12H14ON5
Smiles:
Oc1nc2c(c(NC3CC4CCC3C4)n1)N=C[N]2| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.28 | Num_heavy_atoms: | 18 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
