Glycoside
GD064867
Name:
NoneFormula:
C14H21O8N3Smiles:
COCCn1cc(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cnc1=OAglycone:
COCCn1cc(C(N)=O)cnc1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -3.58 | Num_rotatable_bonds: | 6 |
| MolWt: | 359.34 | Num_heavy_atoms: | 25 |
| TPSA: | 163.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD31217
Formula: C8H11O3N3
Smiles:
COCCn1cc(C(N)=O)cnc1=O| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 197.19 | Num_heavy_atoms: | 14 |
| TPSA: | 87.21 | NumAromaticRings: | 1 |
