Glycoside

GD092731
Name:
[3,4,6-tris(acetyloxy)-5-(furan-2-amido)oxan-2-yl]methyl acetateFormula:
C19H23O11NSmiles:
CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)c2ccco2)[C@@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
COC(C)=O.NC(=O)c1ccco1Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OOther Identifiers
Properties
HBA: | 12 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.53 |
AlogP: | 0.09 | Num_rotatable_bonds: | 7 |
MolWt: | 441.39 | Num_heavy_atoms: | 31 |
TPSA: | 156.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=OHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.67 |
AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
MolWt: | 74.08 | Num_heavy_atoms: | 5 |
TPSA: | 26.3 | NumAromaticRings: | 0 |
AD15345
Formula: C5H5O2N
Smiles:
NC(=O)c1ccco1HBA: | 3 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 0.38 | Num_rotatable_bonds: | 1 |
MolWt: | 111.1 | Num_heavy_atoms: | 8 |
TPSA: | 56.23 | NumAromaticRings: | 1 |