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Fucoxanthin

CAT: 1299-RM-F030800-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-F030800-03Size:50 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
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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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