Glycoside
GD084407
Name:
NoneFormula:
C18H25O6N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NC[C@@H]4COC5(CCCC5)O4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCC2COC3(CCCC3)O2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 5 |
| MolWt: | 407.43 | Num_heavy_atoms: | 29 |
| TPSA: | 144.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD37688
Formula: C13H16O2N5
Smiles:
C1=Nc2c(ncnc2NCC2COC3(CCCC3)O2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 274.3 | Num_heavy_atoms: | 20 |
| TPSA: | 82.73 | NumAromaticRings: | 1 |
