Glycoside
GD018314
Name:
ALMURTIDEFormula:
C18H30O11N4Smiles:
CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@H](O)[C@H]1OCC(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)O)C(N)=OAglycone:
CC(NC(=O)CO)C(=O)NC(CCC(=O)O)C(N)=OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.72 |
| AlogP: | -4.71 | Num_rotatable_bonds: | 12 |
| MolWt: | 478.46 | Num_heavy_atoms: | 33 |
| TPSA: | 246.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD12942
Formula: C10H17O6N3
Smiles:
CC(NC(=O)CO)C(=O)NC(CCC(=O)O)C(N)=O| HBA: | 9 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 0.6 |
| AlogP: | -2.68 | Num_rotatable_bonds: | 8 |
| MolWt: | 275.26 | Num_heavy_atoms: | 19 |
| TPSA: | 158.82 | NumAromaticRings: | 0 |
