Glycoside
GD103466
Name:
NoneFormula:
C25H41O8N2Smiles:
CC[NH+](CC)CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)[C@@H](C(=O)OCCC(C)C)c1ccccc1Aglycone:
CC[NH+](CC)CCNC(C(=O)OCCC(C)C)c1ccccc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 16 |
| MolWt: | 497.61 | Num_heavy_atoms: | 35 |
| TPSA: | 149.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD43815
Formula: C19H33O2N2
Smiles:
CC[NH+](CC)CCNC(C(=O)OCCC(C)C)c1ccccc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.63 |
| AlogP: | 1.83 | Num_rotatable_bonds: | 11 |
| MolWt: | 321.49 | Num_heavy_atoms: | 23 |
| TPSA: | 42.77 | NumAromaticRings: | 1 |
