Glycoside
GD021995
Name:
NoneFormula:
C11H16O6N2Smiles:
CCn1c(=O)ccn(C2O[C@H](CO)[C@H](O)[C@H]2O)c1=OAglycone:
CCn1c(=O)cc[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.64 |
| AlogP: | -2.36 | Num_rotatable_bonds: | 3 |
| MolWt: | 272.26 | Num_heavy_atoms: | 19 |
| TPSA: | 113.92 | NumAromaticRings: | 1 |
Unique Aglycone
AD05157
Formula: C6H8O2N2
Smiles:
CCn1c(=O)cc[nH]c1=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 1 |
| MolWt: | 140.14 | Num_heavy_atoms: | 10 |
| TPSA: | 54.86 | NumAromaticRings: | 1 |
