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Fucoxanthin

CAT: 1299-RM-F030800-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-F030800-04Size:100 mg
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CAS Number
3351-86-8
Synonyms
6'R, ?7'-?didehydro-?5R, ?6-?epoxy-?4', ?5', ?6S, ?7-?tetrahydro-?3S, ?3'S, ?5'R-?trihydroxy-?β, ?β-?caroten-?8 (5H) -?one
Molecular Formula
C42H58O6
Molecular Weight
658.92
Target Alternative Name
Fucoxanthin
Product Name Synonym
6'R, ?7'-?didehydro-?5R, ?6-?epoxy-?4', ?5', ?6S, ?7-?tetrahydro-?3S, ?3'S, ?5'R-?trihydroxy-?β, ?β-?caroten-?8 (5H) -?one

Chemical Information

Fucoxanthin

Fucoxanthin is an epoxycarotenol that is found in brown seaweed and which exhibits anti-cancer, anti-diabetic, anti-oxidative and neuroprotective properties. It has a role as a hypoglycemic agent, a hepatoprotective agent, a neuroprotective agent, a CFTR potentiator, an apoptosis inhibitor, a marine metabolite, a plant metabolite, a food antioxidant and an algal metabolite. It is a tertiary alcohol, an epoxycarotenol, a secondary alcohol, a member of allenes and an acetate ester.

CAS Number3351-86-8
PubChem CID5281239
IUPAC Name[(1S,3R)-3-hydroxy-4-[(3E,5E,7E,9E,11E,13E,15E)-18-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-3,7,12,16-tetramethyl-17-oxooctadeca-1,3,5,7,9,11,13,15-octaenylidene]-3,5,5-trimethylcyclohexyl] acetate
Molecular FormulaC42H58O6
Molecular Weight658.9
XLogP8.1
Topological Polar Surface Area96.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Heavy Atom Count48
Formal Charge0
Complexity1530
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
InChIKey
SJWWTRQNNRNTPU-ABBNZJFMSA-N
Chemical Structure
2D Structure
2D structure of Fucoxanthin
CAS: 3351-86-8
CID: 5281239
Formula: C42H58O6
MW: 658.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight658.9
XLogP38.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Exact Mass658.42333957
Monoisotopic Mass658.42333957
Topological Polar Surface Area96.4 Ų
Heavy Atom Count48
Formal Charge0
Complexity1530
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count7
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TBZ2258Fucoxanthin
A16976-50Fucoxanthin 50mg
A16976-10Fucoxanthin 10mg
A16976-100Fucoxanthin 100mg
A16976-1Fucoxanthin 1mg
HY-N2302R-01Fucoxanthin (Standard)
A16976-500Fucoxanthin 500mg
A16976-5Fucoxanthin 5mg
A16976-25Fucoxanthin 25mg
A16976-2Fucoxanthin 2mg

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