Glycoside
GD117817
Name:
5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,5-dihydro-1H-pyrrol-2-oneFormula:
C10H15O7NSmiles:
OCC1OC(OC2C=CC(O)=N2)C(O)C(O)C1OAglycone:
OC1=NC(O)C=C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | -2.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 261.23 | Num_heavy_atoms: | 18 |
| TPSA: | 131.97 | NumAromaticRings: | 0 |
Unique Aglycone
AD47026
Formula: C4H5O2N
Smiles:
OC1=NC(O)C=C1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 0 |
| MolWt: | 99.09 | Num_heavy_atoms: | 7 |
| TPSA: | 52.82 | NumAromaticRings: | 0 |
