Glycoside
GD027835
Name:
NoneFormula:
C12H23O7N3Smiles:
CCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(=O)N(C)N=OAglycone:
CCCCO.CN(N=O)C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 321.33 | Num_heavy_atoms: | 22 |
| TPSA: | 140.92 | NumAromaticRings: | 0 |
Unique Aglycone
AD00936
Formula: C4H10O
Smiles:
CCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 74.12 | Num_heavy_atoms: | 5 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
AD10725
Formula: C2H5O2N3
Smiles:
CN(N=O)C(N)=O| HBA: | 5 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | -0.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 103.08 | Num_heavy_atoms: | 7 |
| TPSA: | 75.76 | NumAromaticRings: | 0 |
