Glycoside
GD146980
Name:
N-(1,4,5,6-tetrahydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexan-2-yl)acetamideFormula:
C14H27O11NSmiles:
CC(O)=NC(CO)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)COAglycone:
CC(O)=NCCOSugarmoiety:
OCC(O)C(O)C(O)OC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.93 |
| AlogP: | -4.78 | Num_rotatable_bonds: | 9 |
| MolWt: | 385.37 | Num_heavy_atoms: | 26 |
| TPSA: | 212.89 | 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 |
