Glycoside
GD123868
Name:
5-acetamido-4-hydroxy-2-{[2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acidFormula:
C17H29O14NSmiles:
CC(O)=NC1C(O)CC(OC2C(O)C(O)OC(CO)C2O)(C(=O)O)OC1C(O)C(O)COAglycone:
CC(O)=NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 10 | FractionCSP3: | 0.88 |
| AlogP: | -5.21 | Num_rotatable_bonds: | 8 |
| MolWt: | 471.41 | Num_heavy_atoms: | 32 |
| TPSA: | 259.42 | NumAromaticRings: | 0 |
Unique Aglycone
AD44972
Formula: C11H19O9N
Smiles:
CC(O)=NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.82 |
| AlogP: | -3.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 309.27 | Num_heavy_atoms: | 21 |
| TPSA: | 180.27 | NumAromaticRings: | 0 |
