Glycoside
GD132856
Name:
N-({3,4-dihydroxy-5-[2-oxo-2-(pyrrolidin-1-yl)ethyl]oxolan-2-yl}methyl)-2-ethylbutanamideFormula:
C17H30O5N2Smiles:
CCC(CC)C(O)=NCC1OC(CC(=O)N2CCCC2)C(O)C1OAglycone:
CC(=O)N1CCCC1.CCC(CC)C(O)=NCSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 7 |
| MolWt: | 342.44 | Num_heavy_atoms: | 24 |
| TPSA: | 102.59 | NumAromaticRings: | 0 |
Unique Aglycone
AD26841
Formula: C6H11ON
Smiles:
CC(=O)N1CCCC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.83 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 0 |
| MolWt: | 113.16 | Num_heavy_atoms: | 8 |
| TPSA: | 20.31 | NumAromaticRings: | 0 |
AD47915
Formula: C7H15ON
Smiles:
CCC(CC)C(O)=NC| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 129.2 | Num_heavy_atoms: | 9 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
