Glycoside
GD008667
Name:
NoneFormula:
C18H38O7N8Smiles:
NC(N)=NCCCC(N)C(=O)NCC1OC(OC2C(N)CC(N)C(O)C2O)C(N)C(O)C1OAglycone:
CNC(=O)C(N)CCCN=C(N)N.NC1CC(N)C(O)C(O)C1OSugarmoiety:
NC1C(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 17 | FractionCSP3: | 0.89 |
| AlogP: | -6.58 | Num_rotatable_bonds: | 9 |
| MolWt: | 478.55 | Num_heavy_atoms: | 33 |
| TPSA: | 296.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD00009
Formula: C6H14O3N2
Smiles:
NC1CC(N)C(O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.19 | Num_heavy_atoms: | 11 |
| TPSA: | 112.73 | NumAromaticRings: | 0 |
AD06893
Formula: C7H17ON5
Smiles:
CNC(=O)C(N)CCCN=C(N)N| HBA: | 6 | RingCount: | 0 |
| HBD: | 7 | FractionCSP3: | 0.71 |
| AlogP: | -1.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 187.25 | Num_heavy_atoms: | 13 |
| TPSA: | 119.52 | NumAromaticRings: | 0 |
