Glycoside
GD018835
Name:
NoneFormula:
C11H18O5N2Smiles:
CCc1[nH]c(C(C)=O)nc1[C@H](O)[C@H](O)[C@H](O)COAglycone:
CCc1cnc(C(C)=O)[nH]1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 258.27 | Num_heavy_atoms: | 18 |
| TPSA: | 126.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD13216
Formula: C7H10ON2
Smiles:
CCc1cnc(C(C)=O)[nH]1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 138.17 | Num_heavy_atoms: | 10 |
| TPSA: | 45.75 | NumAromaticRings: | 1 |
