Glycoside
GD149133
Name:
NoneFormula:
C24H36O5N6Smiles:
CN(Cc1ccccc1)Cc1cn(CC2OC(CC(O)=NCCN3CCOCC3)C(O)C2O)nn1Aglycone:
CC(O)=NCCN1CCOCC1.CN(Cc1ccccc1)Cc1cn(C)nn1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 11 |
| MolWt: | 488.59 | Num_heavy_atoms: | 35 |
| TPSA: | 128.7 | NumAromaticRings: | 2 |
Unique Aglycone
AD38153
Formula: C12H16N4
Smiles:
CN(Cc1ccccc1)Cc1cn(C)nn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 216.29 | Num_heavy_atoms: | 16 |
| TPSA: | 33.95 | NumAromaticRings: | 2 |
AD45716
Formula: C8H16O2N2
Smiles:
CC(O)=NCCN1CCOCC1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 172.23 | Num_heavy_atoms: | 12 |
| TPSA: | 45.06 | NumAromaticRings: | 0 |
