Glycoside
GD122950
Name:
2,27-diamino-26-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octacosan-11-oneFormula:
C34H68O7N2Smiles:
CC(N)CCCCCCCCC(=O)CCCCCCCCCCCCCCC(OC1OC(CO)C(O)C(O)C1O)C(C)NAglycone:
CC(N)CCCCCCCCC(=O)CCCCCCCCCCCCCCC(O)C(C)NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.97 |
| AlogP: | 5.02 | Num_rotatable_bonds: | 28 |
| MolWt: | 616.93 | Num_heavy_atoms: | 43 |
| TPSA: | 168.49 | NumAromaticRings: | 0 |
Unique Aglycone
AD49589
Formula: C28H58O2N2
Smiles:
CC(N)CCCCCCCCC(=O)CCCCCCCCCCCCCCC(O)C(C)N| HBA: | 4 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.96 |
| AlogP: | 7.19 | Num_rotatable_bonds: | 25 |
| MolWt: | 454.78 | Num_heavy_atoms: | 32 |
| TPSA: | 89.34 | NumAromaticRings: | 0 |
