Glycoside
GD119298
Name:
N-(1,3-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tetradeca-4,8-dien-2-yl)-2-hydroxypentacosanamideFormula:
C45H85O10NSmiles:
CCCCCC=CCCC=CC(O)C(N=C(O)C(O)CCCCCCCCCCCCCCCCCCCCCCC)C(O)OC1OC(CO)C(O)C(O)C1OAglycone:
CCCCCC=CCCC=CC(O)C(N=C(O)C(O)CCCCCCCCCCCCCCCCCCCCCCC)C(O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.89 |
| AlogP: | 8.24 | Num_rotatable_bonds: | 37 |
| MolWt: | 800.17 | Num_heavy_atoms: | 56 |
| TPSA: | 192.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD47766
Formula: C39H75O5N
Smiles:
CCCCCC=CCCC=CC(O)C(N=C(O)C(O)CCCCCCCCCCCCCCCCCCCCCCC)C(O)O| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | 10.42 | Num_rotatable_bonds: | 34 |
| MolWt: | 638.03 | Num_heavy_atoms: | 45 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
