Glycoside
GD077074
Name:
NoneFormula:
C18H25O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCC(O)(C4CC4)C4CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OC(CNc1ncnc2c1N=C[N]2)(C1CC1)C1CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 391.43 | Num_heavy_atoms: | 28 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD35397
Formula: C13H16ON5
Smiles:
OC(CNc1ncnc2c1N=C[N]2)(C1CC1)C1CC1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 258.31 | Num_heavy_atoms: | 19 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
