Glycoside
GD099055
Name:
NoneFormula:
C23H42O8N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C2CC[NH+]([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCC([NH+]2CCC(C(=O)NCCO)CC2)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.91 |
| AlogP: | -1.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 488.6 | Num_heavy_atoms: | 34 |
| TPSA: | 142.23 | NumAromaticRings: | 0 |
Unique Aglycone
AD42168
Formula: C17H32O4N3
Smiles:
CC(C)(C)OC(=O)N1CCC([NH+]2CCC(C(=O)NCCO)CC2)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 342.46 | Num_heavy_atoms: | 24 |
| TPSA: | 83.31 | NumAromaticRings: | 0 |
