Glycoside
GD077030
Name:
NoneFormula:
C18H25O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4CCC[C@@H]5OCC[C@@H]54)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NC2CCCC3OCCC23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 391.43 | Num_heavy_atoms: | 28 |
| TPSA: | 134.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD35377
Formula: C13H16ON5
Smiles:
C1=Nc2c(ncnc2NC2CCCC3OCCC23)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 2 |
| MolWt: | 258.3 | Num_heavy_atoms: | 19 |
| TPSA: | 73.5 | NumAromaticRings: | 1 |
