Glycoside
GD096384
Name:
NoneFormula:
C21H40O8N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C[N@H+](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
C[NH+](CC(=O)NCCO)C1CCCN(C(=O)OC(C)(C)C)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.9 |
| AlogP: | -2.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 462.56 | Num_heavy_atoms: | 32 |
| TPSA: | 142.23 | NumAromaticRings: | 0 |
Unique Aglycone
AD40992
Formula: C15H30O4N3
Smiles:
C[NH+](CC(=O)NCCO)C1CCCN(C(=O)OC(C)(C)C)C1| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.87 |
| AlogP: | -0.99 | Num_rotatable_bonds: | 5 |
| MolWt: | 316.42 | Num_heavy_atoms: | 22 |
| TPSA: | 83.31 | NumAromaticRings: | 0 |
