Glycoside
GD045958
Name:
NoneFormula:
C14H23O5N2Smiles:
CC(C)c1cccc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)[nH+]1Aglycone:
CC(C)c1cccc(N)[nH+]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -1.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 299.35 | Num_heavy_atoms: | 21 |
| TPSA: | 116.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD25291
Formula: C8H13N2
Smiles:
CC(C)c1cccc(N)[nH+]1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 1 |
| MolWt: | 137.21 | Num_heavy_atoms: | 10 |
| TPSA: | 40.16 | NumAromaticRings: | 1 |
