Glycoside
GD042429
Name:
NoneFormula:
C12H18O4NSmiles:
O[C@H]1CO[C@@H]([NH2+]Cc2ccccc2)[C@H](O)[C@H]1OAglycone:
[NH3+]Cc1ccccc1Sugarmoiety:
OC1COC([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 3 |
| MolWt: | 240.28 | Num_heavy_atoms: | 17 |
| TPSA: | 86.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD24850
Formula: C7H10N
Smiles:
[NH3+]Cc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.16 | Num_heavy_atoms: | 8 |
| TPSA: | 27.64 | NumAromaticRings: | 1 |
