fucoxanthin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 221
Total Number of Articles : 149
PubChem 5281239
Molecular Formula

C42H58O6

SMILES

C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C(=O)C[C@]12[C@](O1)(C[C@H](CC2(C)C)O)C)/C=C/C=C(\C)/C=C=C3[C@](C[C@H](CC3(C)C)OC(=O)C)(C)O

InChI

InChI=1S/C42H58O6/c1-29(18-14-19-31(3)22-23-37-38(6,7)26-35(47-33(5)43)27-40(37,10)46)16-12-13-17-30(2)20-15-21-32(4)36(45)28-42-39(8,9)24-34(44)25-41(42,11)48-42/h12-22,34-35,44,46H,24-28H2,1-11H3/b13-12+,18-14+,20-15+,29-16+,30-17+,31-19+,32-21+/t23?,34-,35-,40+,41+,42-/m0/s1

synonyms
  • Fucoxanthin
  • 3351-86-8
  • all-trans-Fucoxanthin
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Properties
Property Value
MW 658.9 g/mol
HBD 2
HBA 6
Rotatable Bond Count 12
Exact Mass 658.42333957 g/mol
Monoisotopic Mass 658.42333957 g/mol
Heavy Atom Count 48
Isotope Atom Count 0
Atom Stereo Count 5
Covalent Unit Count 1
Complexity 1530
xlogp 8.1
Topological Polar Surface Area 96.4