Glycoside
GD039735
Name:
6,7,8,9-tetrahydroxy-5-methylcarboxamido-4-oxononanoic acidFormula:
C11H19O8NSmiles:
CC(=O)N[C@@H](C(=O)CCC(=O)O)[C@@H](O)[C@@H](O)[C@@H](O)COAglycone:
CCC(=O)OSugarmoiety:
CC(=O)NC(C(=O)O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 0.73 |
| AlogP: | -3.0 | Num_rotatable_bonds: | 9 |
| MolWt: | 293.27 | Num_heavy_atoms: | 20 |
| TPSA: | 164.39 | NumAromaticRings: | 0 |
Unique Aglycone
AD00155
Formula: C3H6O2
Smiles:
CCC(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 1 |
| MolWt: | 74.08 | Num_heavy_atoms: | 5 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
