Glycoside
GD146349
Name:
2-(octadeca-6,9,12,15-tetraenoyloxy)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propyl icosa-5,8,11,14,17-pentaenoateFormula:
C47H72O10Smiles:
CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OCC(COC1OC(CO)C(O)C(O)C1O)OC(=O)CCCCC=CCC=CCC=CCC=CCCAglycone:
CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OCC(CO)OC(=O)CCCCC=CCC=CCC=CCC=CCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | 8.55 | Num_rotatable_bonds: | 32 |
| MolWt: | 797.08 | Num_heavy_atoms: | 57 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD55004
Formula: C41H62O5
Smiles:
CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OCC(CO)OC(=O)CCCCC=CCC=CCC=CCC=CCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.51 |
| AlogP: | 10.72 | Num_rotatable_bonds: | 29 |
| MolWt: | 634.94 | Num_heavy_atoms: | 46 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
