Glycoside
GD092079
Name:
NoneFormula:
C22H38O6N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc(CN(C)CCC[NH+](C)C)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CN(CCC[NH+](C)C)Cc1ccc(C(=O)NCCO)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 11 |
| MolWt: | 440.56 | Num_heavy_atoms: | 31 |
| TPSA: | 115.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD40201
Formula: C16H28O2N3
Smiles:
CN(CCC[NH+](C)C)Cc1ccc(C(=O)NCCO)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 9 |
| MolWt: | 294.42 | Num_heavy_atoms: | 21 |
| TPSA: | 57.01 | NumAromaticRings: | 1 |
