Glycoside
GD152656
Name:
[3,4-dihydroxy-5-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-yl]methyl octadeca-9,12,15-trienoateFormula:
C30H50O12Smiles:
CCC=CCC=CCC=CCCCCCCCC(=O)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OAglycone:
CCC=CCC=CCC=CCCCCCCCC(=O)OCSugarmoiety:
OCC1OC(OC2(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.77 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 19 |
| MolWt: | 602.72 | Num_heavy_atoms: | 42 |
| TPSA: | 195.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD17906
Formula: C19H32O2
Smiles:
CCC=CCC=CCC=CCCCCCCCC(=O)OC| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.63 |
| AlogP: | 5.75 | Num_rotatable_bonds: | 13 |
| MolWt: | 292.46 | Num_heavy_atoms: | 21 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
