Glycoside
GD088803
Name:
NoneFormula:
C21H32O7N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc(C(=O)N3CCC([NH3+])CC3)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
[NH3+]C1CCN(C(=O)c2ccc(C(=O)NCCO)cc2)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.62 |
| AlogP: | -1.89 | Num_rotatable_bonds: | 6 |
| MolWt: | 438.5 | Num_heavy_atoms: | 31 |
| TPSA: | 156.2 | NumAromaticRings: | 1 |
Unique Aglycone
AD38854
Formula: C15H22O3N3
Smiles:
[NH3+]C1CCN(C(=O)c2ccc(C(=O)NCCO)cc2)CC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 4 |
| MolWt: | 292.36 | Num_heavy_atoms: | 21 |
| TPSA: | 97.28 | NumAromaticRings: | 1 |
