Glycoside
GD014581
Name:
NoneFormula:
C18H23O6N3Smiles:
O=C(NCC1CC1)c1ccc2[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2c1Aglycone:
O=C(NCC1CC1)c1ccc2[nH]cnc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 5 |
| MolWt: | 377.4 | Num_heavy_atoms: | 27 |
| TPSA: | 147.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD10701
Formula: C12H13ON3
Smiles:
O=C(NCC1CC1)c1ccc2[nH]cnc2c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 215.26 | Num_heavy_atoms: | 16 |
| TPSA: | 57.78 | NumAromaticRings: | 2 |
