Glycoside
GD114850
Name:
N-(3-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,4,5,6-tetrahydroxyhexan-2-yl)acetamideFormula:
C16H30O11N2Smiles:
CC(O)=NC(CO)C(OC1OC(CO)C(O)C(O)C1N=C(C)O)C(O)C(O)COAglycone:
CC(O)=NCCOSugarmoiety:
CC(O)=NC1C(OC(O)C(O)C(O)CO)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.88 |
| AlogP: | -3.79 | Num_rotatable_bonds: | 10 |
| MolWt: | 426.42 | Num_heavy_atoms: | 29 |
| TPSA: | 225.25 | NumAromaticRings: | 0 |
Unique Aglycone
AD45321
Formula: C4H9O2N
Smiles:
CC(O)=NCCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 2 |
| MolWt: | 103.12 | Num_heavy_atoms: | 7 |
| TPSA: | 52.82 | NumAromaticRings: | 0 |
