Glycoside
GD067273
Name:
NoneFormula:
C16H26O6N3Smiles:
N#CCCC[N@@H+]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1OAglycone:
N#CCCC[NH+]1CC2CCC(C1)N2C=OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -3.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 356.4 | Num_heavy_atoms: | 25 |
| TPSA: | 138.69 | NumAromaticRings: | 0 |
Unique Aglycone
AD32113
Formula: C11H18ON3
Smiles:
N#CCCC[NH+]1CC2CCC(C1)N2C=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.82 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 4 |
| MolWt: | 208.28 | Num_heavy_atoms: | 15 |
| TPSA: | 48.54 | NumAromaticRings: | 0 |
