Glycoside
GD127847
Name:
3-ethyl-4-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,5-dihydro-1H-pyrrole-2,5-dioneFormula:
C13H19O7NSmiles:
CCC1=C(C)C(=O)N(C2OC(CO)C(O)C(O)C2O)C1=OAglycone:
CCC1=C(C)C(=O)NC1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -2.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 301.3 | Num_heavy_atoms: | 21 |
| TPSA: | 127.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD51780
Formula: C7H9O2N
Smiles:
CCC1=C(C)C(=O)NC1=O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.15 | Num_heavy_atoms: | 10 |
| TPSA: | 46.17 | NumAromaticRings: | 0 |
