Glycoside
GD010174
Name:
NoneFormula:
C12H17O6NSmiles:
COc1c(C)n(C2O[C@H](CO)[C@H](O)[C@H]2O)ccc1=OAglycone:
COc1c(C)[nH]ccc1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 271.27 | Num_heavy_atoms: | 19 |
| TPSA: | 101.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD07899
Formula: C7H9O2N
Smiles:
COc1c(C)[nH]ccc1=O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.15 | Num_heavy_atoms: | 10 |
| TPSA: | 42.09 | NumAromaticRings: | 1 |
