Glycoside
GD089356
Name:
NoneFormula:
C21H32O5N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CCC(CCN5CCOCC5)CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N2CCC(CCN3CCOCC3)CC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 6 |
| MolWt: | 448.52 | Num_heavy_atoms: | 32 |
| TPSA: | 129.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD38979
Formula: C16H23ON6
Smiles:
C1=Nc2c(ncnc2N2CCC(CCN3CCOCC3)CC2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.69 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 315.4 | Num_heavy_atoms: | 23 |
| TPSA: | 67.95 | NumAromaticRings: | 1 |
