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Showing metabocard for Zeaxanthin (HMDB0002789)

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Record Information
Version5.0
StatusDetected and Quantified
Creation Date2006-05-22 15:12:10 UTC
Update Date2022-03-07 02:49:17 UTC
HMDB IDHMDB0002789
Secondary Accession Numbers
  • HMDB02789
Metabolite Identification
Common NameZeaxanthin
DescriptionZeaxanthin is a carotenoid xanthophyll and is one of the most common carotenoid found in nature. It is the pigment that gives corn, saffron, and many other plants their characteristic color. Zeaxanthin breaks down to form picrocrocin and safranal, which are responsible for the taste and aroma of saffron Carotenoids are among the most common pigments in nature and are natural lipid soluble antioxidants. Zeaxanthin is one of the two carotenoids (the other is lutein) that accumulate in the eye lens and macular region of the retina with concentrations in the macula greater than those found in plasma and other tissues. Lutein and zeaxanthin have identical chemical formulas and are isomers, but they are not stereoisomers. The main difference between them is in the location of a double bond in one of the end rings. This difference gives lutein three chiral centers whereas zeaxanthin has two. A relationship between macular pigment optical density, a marker of lutein and zeaxanthin concentration in the macula, and lens optical density, an antecedent of cataractous changes, has been suggested. The xanthophylls may act to protect the eye from ultraviolet phototoxicity via quenching reactive oxygen species and/or other mechanisms. Some observational studies have shown that generous intakes of lutein and zeaxanthin, particularly from certain xanthophyll-rich foods like spinach, broccoli and eggs, are associated with a significant reduction in the risk for cataract (up to 20%) and for age-related macular degeneration (up to 40%). While the pathophysiology of cataract and age-related macular degeneration is complex and contains both environmental and genetic components, research studies suggest dietary factors including antioxidant vitamins and xanthophylls may contribute to a reduction in the risk of these degenerative eye diseases. Further research is necessary to confirm these observations. (PMID: 11023002 ). Zeaxanthin has been found to be a microbial metabolite, it can be produced by Algibacter, Aquibacter, Escherichia, Flavobacterium, Formosa, Gramella, Hyunsoonleella, Kordia, Mesoflavibacter, Muricauda, Nubsella, Paracoccus, Siansivirga, Sphingomonas, Zeaxanthinibacter and yeast (https://reader.elsevier.com/reader/sd/pii/S0924224417302571?token=DE6BC6CC7DCDEA6150497AA3E375097A00F8E0C12AE03A8E420D85D1AC8855E62103143B5AE0B57E9C5828671F226801). It is a marker for the activity of Bacillus subtilis and/or Pseudomonas aeruginosa in the intestine. Higher levels are associated with higher levels of Bacillus or Pseudomonas. (PMID: 17555270 ; PMID: 12147474 )
Structure
Data?1582752256
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0002789 (Zeaxanthin)


  Mrv1652309042000272D          

 42 43  0  0  0  0            999 V2000
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M  END
Download

3D MOL for HMDB0002789 (Zeaxanthin)

HMDB0002789
     RDKit          3D
Zeaxanthin
 98 99  0  0  0  0  0  0  0  0999 V2000
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 42 97  1  0
 42 98  1  0
M  END
Download

3D SDF for HMDB0002789 (Zeaxanthin)


  Mrv1652309042000272D          

 42 43  0  0  0  0            999 V2000
 9993.907910000.1916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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10000.3372 9999.7786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.051010000.1916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.7648 9999.7786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <DATABASE_ID>
HMDB0002789

> <DATABASE_NAME>
hmdb

> <SMILES>
C\C(\C=C\C=C(/C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1

> <INCHI_KEY>
JKQXZKUSFCKOGQ-QAYBQHTQSA-N

> <FORMULA>
C40H56O2

> <MOLECULAR_WEIGHT>
568.886

> <EXACT_MASS>
568.428031043

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
98

> <JCHEM_AVERAGE_POLARIZABILITY>
73.46744361216797

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-3,5,5-trimethylcyclohex-3-en-1-ol

> <ALOGPS_LOGP>
8.30

> <JCHEM_LOGP>
8.350644046

> <ALOGPS_LOGS>
-5.94

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
18.907213404525137

> <JCHEM_PKA_STRONGEST_ACIDIC>
18.907213404525137

> <JCHEM_PKA_STRONGEST_BASIC>
-0.7887548611967236

> <JCHEM_POLAR_SURFACE_AREA>
40.46

> <JCHEM_REFRACTIVITY>
194.9508

> <JCHEM_ROTATABLE_BOND_COUNT>
10

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
6.49e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
zeaxanthin

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0002789 (Zeaxanthin)

HMDB0002789
     RDKit          3D
Zeaxanthin
 98 99  0  0  0  0  0  0  0  0999 V2000
  -11.9427    3.0941   -0.8978 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3491    1.7369   -0.3913 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4014    0.8648   -0.0753 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0116    1.2893   -0.2447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9773    0.5059    0.0298 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3 36  1  0
 36 37  1  0
 36 38  1  0
 36 39  1  0
 39 40  1  0
 40 41  1  0
 40 42  1  0
 42  2  1  0
 33 26  1  0
  1 43  1  0
  1 44  1  0
  1 45  1  0
  4 46  1  0
  5 47  1  0
  7 48  1  0
  7 49  1  0
  7 50  1  0
  8 51  1  0
  9 52  1  0
 10 53  1  0
 12 54  1  0
 12 55  1  0
 12 56  1  0
 13 57  1  0
 14 58  1  0
 15 59  1  0
 16 60  1  0
 18 61  1  0
 18 62  1  0
 18 63  1  0
 19 64  1  0
 20 65  1  0
 21 66  1  0
 23 67  1  0
 23 68  1  0
 23 69  1  0
 24 70  1  0
 25 71  1  0
 28 72  1  0
 28 73  1  0
 28 74  1  0
 29 75  1  0
 29 76  1  0
 30 77  1  1
 31 78  1  0
 32 79  1  0
 32 80  1  0
 34 81  1  0
 34 82  1  0
 34 83  1  0
 35 84  1  0
 35 85  1  0
 35 86  1  0
 37 87  1  0
 37 88  1  0
 37 89  1  0
 38 90  1  0
 38 91  1  0
 38 92  1  0
 39 93  1  0
 39 94  1  0
 40 95  1  6
 41 96  1  0
 42 97  1  0
 42 98  1  0
M  END
Download

PDB for HMDB0002789 (Zeaxanthin)

HEADER    PROTEIN                                 04-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   04-SEP-20         0                                  
HETATM    1  C   UNK     0    8655.2958667.024   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0    8656.6288666.253   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0    8657.9658667.024   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0    8659.2988666.253   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0    8660.6318667.024   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0    8661.9648666.253   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0    8663.2978667.024   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0    8664.6308666.253   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0    8665.9638667.024   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0    8667.2968666.253   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0    8668.6298667.024   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0    8669.9618666.253   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0    8671.2978667.024   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0    8672.6308666.253   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0    8673.9628667.024   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0    8675.2948666.253   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0    8676.6278667.024   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0    8677.9638666.253   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0    8681.6028665.058   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0    8679.6428665.077   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0    8677.9638669.331   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0    8683.2968669.331   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0    8675.2948664.714   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0    8669.9618664.714   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0    8663.2978668.565   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0    8657.9658668.565   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0    8651.6588668.222   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0    8653.6188668.206   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0    8655.2958663.946   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0    8649.9628663.946   0.000  0.00  0.00           O+0
HETATM   31  C   UNK     0    8652.6298667.024   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0    8651.2958666.254   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0    8651.2958664.714   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0    8652.6298663.944   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0    8653.9628664.714   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0    8653.9628666.254   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0    8680.6308669.334   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0    8679.2978668.564   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0    8679.2978667.024   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0    8680.6308666.254   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0    8681.9648667.024   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0    8681.9648668.564   0.000  0.00  0.00           C+0
CONECT    1    2   36                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4   26                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8   25                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   24                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17   23                                                  
CONECT   17   16   18                                                       
CONECT   18   17   39                                                       
CONECT   19   40                                                            
CONECT   20   40                                                            
CONECT   21   38                                                            
CONECT   22   42                                                            
CONECT   23   16                                                            
CONECT   24   12                                                            
CONECT   25    7                                                            
CONECT   26    3                                                            
CONECT   27   31                                                            
CONECT   28   31                                                            
CONECT   29   35                                                            
CONECT   30   33                                                            
CONECT   31   32   36   27   28                                             
CONECT   32   31   33                                                       
CONECT   33   32   34   30                                                  
CONECT   34   33   35                                                       
CONECT   35   34   36   29                                                  
CONECT   36   31   35    1                                                  
CONECT   37   38   42                                                       
CONECT   38   37   39   21                                                  
CONECT   39   38   40   18                                                  
CONECT   40   39   41   19   20                                             
CONECT   41   40   42                                                       
CONECT   42   37   41   22                                                  
MASTER        0    0    0    0    0    0    0    0   42    0   86    0
END
Download

3D PDB for HMDB0002789 (Zeaxanthin)

COMPND    HMDB0002789
HETATM    1  C1  UNL     1     -11.943   3.094  -0.898  1.00  0.00           C  
HETATM    2  C2  UNL     1     -12.349   1.737  -0.391  1.00  0.00           C  
HETATM    3  C3  UNL     1     -11.401   0.865  -0.075  1.00  0.00           C  
HETATM    4  C4  UNL     1     -10.012   1.289  -0.245  1.00  0.00           C  
HETATM    5  C5  UNL     1      -8.977   0.506   0.030  1.00  0.00           C  
HETATM    6  C6  UNL     1      -7.580   0.871  -0.114  1.00  0.00           C  
HETATM    7  C7  UNL     1      -7.155   2.197  -0.626  1.00  0.00           C  
HETATM    8  C8  UNL     1      -6.657  -0.013   0.201  1.00  0.00           C  
HETATM    9  C9  UNL     1      -5.204   0.289   0.089  1.00  0.00           C  
HETATM   10  C10 UNL     1      -4.344  -0.623   0.398  1.00  0.00           C  
HETATM   11  C11 UNL     1      -2.895  -0.343   0.300  1.00  0.00           C  
HETATM   12  C12 UNL     1      -2.330   0.954  -0.117  1.00  0.00           C  
HETATM   13  C13 UNL     1      -2.056  -1.288   0.595  1.00  0.00           C  
HETATM   14  C14 UNL     1      -0.632  -1.202   0.565  1.00  0.00           C  
HETATM   15  C15 UNL     1       0.392  -1.834   0.744  1.00  0.00           C  
HETATM   16  C16 UNL     1       1.715  -1.245   0.565  1.00  0.00           C  
HETATM   17  C17 UNL     1       2.840  -1.868   0.752  1.00  0.00           C  
HETATM   18  C18 UNL     1       2.845  -3.271   1.184  1.00  0.00           C  
HETATM   19  C19 UNL     1       4.091  -1.166   0.501  1.00  0.00           C  
HETATM   20  C20 UNL     1       5.286  -1.711   0.649  1.00  0.00           C  
HETATM   21  C21 UNL     1       6.435  -0.822   0.339  1.00  0.00           C  
HETATM   22  C22 UNL     1       7.697  -1.155   0.413  1.00  0.00           C  
HETATM   23  C23 UNL     1       8.079  -2.502   0.841  1.00  0.00           C  
HETATM   24  C24 UNL     1       8.749  -0.168   0.024  1.00  0.00           C  
HETATM   25  C25 UNL     1       9.997  -0.538   0.087  1.00  0.00           C  
HETATM   26  C26 UNL     1      11.173   0.210  -0.231  1.00  0.00           C  
HETATM   27  C27 UNL     1      12.370  -0.423  -0.061  1.00  0.00           C  
HETATM   28  C28 UNL     1      12.353  -1.834   0.452  1.00  0.00           C  
HETATM   29  C29 UNL     1      13.660   0.231  -0.372  1.00  0.00           C  
HETATM   30  C30 UNL     1      13.597   1.114  -1.561  1.00  0.00           C  
HETATM   31  O1  UNL     1      14.181   0.498  -2.686  1.00  0.00           O  
HETATM   32  C31 UNL     1      12.227   1.543  -1.931  1.00  0.00           C  
HETATM   33  C32 UNL     1      11.289   1.568  -0.702  1.00  0.00           C  
HETATM   34  C33 UNL     1      10.090   2.315  -1.187  1.00  0.00           C  
HETATM   35  C34 UNL     1      11.939   2.481   0.357  1.00  0.00           C  
HETATM   36  C35 UNL     1     -11.719  -0.477   0.451  1.00  0.00           C  
HETATM   37  C36 UNL     1     -11.147  -0.677   1.835  1.00  0.00           C  
HETATM   38  C37 UNL     1     -11.208  -1.553  -0.460  1.00  0.00           C  
HETATM   39  C38 UNL     1     -13.228  -0.694   0.578  1.00  0.00           C  
HETATM   40  C39 UNL     1     -14.002   0.007  -0.506  1.00  0.00           C  
HETATM   41  O2  UNL     1     -13.484  -0.338  -1.728  1.00  0.00           O  
HETATM   42  C40 UNL     1     -13.798   1.497  -0.273  1.00  0.00           C  
HETATM   43  H1  UNL     1     -12.799   3.699  -1.233  1.00  0.00           H  
HETATM   44  H2  UNL     1     -11.326   3.600  -0.148  1.00  0.00           H  
HETATM   45  H3  UNL     1     -11.334   2.917  -1.819  1.00  0.00           H  
HETATM   46  H4  UNL     1      -9.800   2.274  -0.601  1.00  0.00           H  
HETATM   47  H5  UNL     1      -9.207  -0.500   0.379  1.00  0.00           H  
HETATM   48  H6  UNL     1      -6.797   2.844   0.176  1.00  0.00           H  
HETATM   49  H7  UNL     1      -7.977   2.729  -1.142  1.00  0.00           H  
HETATM   50  H8  UNL     1      -6.382   2.064  -1.438  1.00  0.00           H  
HETATM   51  H9  UNL     1      -6.980  -1.000   0.562  1.00  0.00           H  
HETATM   52  H10 UNL     1      -4.958   1.273  -0.248  1.00  0.00           H  
HETATM   53  H11 UNL     1      -4.702  -1.580   0.727  1.00  0.00           H  
HETATM   54  H12 UNL     1      -3.121   1.657  -0.396  1.00  0.00           H  
HETATM   55  H13 UNL     1      -1.752   1.457   0.704  1.00  0.00           H  
HETATM   56  H14 UNL     1      -1.696   0.839  -1.027  1.00  0.00           H  
HETATM   57  H15 UNL     1      -2.466  -2.282   0.902  1.00  0.00           H  
HETATM   58  H16 UNL     1      -0.376  -0.071   0.246  1.00  0.00           H  
HETATM   59  H17 UNL     1       0.240  -2.896   1.049  1.00  0.00           H  
HETATM   60  H18 UNL     1       1.795  -0.178   0.249  1.00  0.00           H  
HETATM   61  H19 UNL     1       3.772  -3.513   1.803  1.00  0.00           H  
HETATM   62  H20 UNL     1       2.010  -3.332   1.959  1.00  0.00           H  
HETATM   63  H21 UNL     1       2.656  -4.011   0.403  1.00  0.00           H  
HETATM   64  H22 UNL     1       4.065  -0.116   0.165  1.00  0.00           H  
HETATM   65  H23 UNL     1       5.427  -2.703   0.957  1.00  0.00           H  
HETATM   66  H24 UNL     1       6.265   0.215  -0.000  1.00  0.00           H  
HETATM   67  H25 UNL     1       8.903  -2.435   1.631  1.00  0.00           H  
HETATM   68  H26 UNL     1       7.278  -3.046   1.393  1.00  0.00           H  
HETATM   69  H27 UNL     1       8.567  -3.113   0.046  1.00  0.00           H  
HETATM   70  H28 UNL     1       8.487   0.802  -0.271  1.00  0.00           H  
HETATM   71  H29 UNL     1      10.159  -1.607   0.423  1.00  0.00           H  
HETATM   72  H30 UNL     1      11.870  -2.510  -0.231  1.00  0.00           H  
HETATM   73  H31 UNL     1      13.409  -2.111   0.748  1.00  0.00           H  
HETATM   74  H32 UNL     1      11.824  -1.860   1.439  1.00  0.00           H  
HETATM   75  H33 UNL     1      14.364  -0.629  -0.623  1.00  0.00           H  
HETATM   76  H34 UNL     1      14.098   0.726   0.523  1.00  0.00           H  
HETATM   77  H35 UNL     1      14.223   2.035  -1.363  1.00  0.00           H  
HETATM   78  H36 UNL     1      14.264  -0.460  -2.589  1.00  0.00           H  
HETATM   79  H37 UNL     1      12.174   2.572  -2.347  1.00  0.00           H  
HETATM   80  H38 UNL     1      11.700   0.862  -2.636  1.00  0.00           H  
HETATM   81  H39 UNL     1       9.496   2.805  -0.416  1.00  0.00           H  
HETATM   82  H40 UNL     1      10.465   3.216  -1.824  1.00  0.00           H  
HETATM   83  H41 UNL     1       9.475   1.781  -1.933  1.00  0.00           H  
HETATM   84  H42 UNL     1      11.245   3.290   0.676  1.00  0.00           H  
HETATM   85  H43 UNL     1      12.183   1.902   1.260  1.00  0.00           H  
HETATM   86  H44 UNL     1      12.808   2.965  -0.123  1.00  0.00           H  
HETATM   87  H45 UNL     1     -10.505   0.203   2.138  1.00  0.00           H  
HETATM   88  H46 UNL     1     -11.982  -0.684   2.600  1.00  0.00           H  
HETATM   89  H47 UNL     1     -10.616  -1.630   1.972  1.00  0.00           H  
HETATM   90  H48 UNL     1     -10.592  -2.330   0.084  1.00  0.00           H  
HETATM   91  H49 UNL     1     -12.059  -2.167  -0.861  1.00  0.00           H  
HETATM   92  H50 UNL     1     -10.640  -1.220  -1.326  1.00  0.00           H  
HETATM   93  H51 UNL     1     -13.388  -1.794   0.458  1.00  0.00           H  
HETATM   94  H52 UNL     1     -13.598  -0.342   1.553  1.00  0.00           H  
HETATM   95  H53 UNL     1     -15.062  -0.228  -0.362  1.00  0.00           H  
HETATM   96  H54 UNL     1     -13.474   0.341  -2.418  1.00  0.00           H  
HETATM   97  H55 UNL     1     -14.410   2.040  -0.980  1.00  0.00           H  
HETATM   98  H56 UNL     1     -14.110   1.716   0.789  1.00  0.00           H  
CONECT    1    2   43   44   45
CONECT    2    3    3   42
CONECT    3    4   36
CONECT    4    5    5   46
CONECT    5    6   47
CONECT    6    7    8    8
CONECT    7   48   49   50
CONECT    8    9   51
CONECT    9   10   10   52
CONECT   10   11   53
CONECT   11   12   13   13
CONECT   12   54   55   56
CONECT   13   14   57
CONECT   14   15   15   58
CONECT   15   16   59
CONECT   16   17   17   60
CONECT   17   18   19
CONECT   18   61   62   63
CONECT   19   20   20   64
CONECT   20   21   65
CONECT   21   22   22   66
CONECT   22   23   24
CONECT   23   67   68   69
CONECT   24   25   25   70
CONECT   25   26   71
CONECT   26   27   27   33
CONECT   27   28   29
CONECT   28   72   73   74
CONECT   29   30   75   76
CONECT   30   31   32   77
CONECT   31   78
CONECT   32   33   79   80
CONECT   33   34   35
CONECT   34   81   82   83
CONECT   35   84   85   86
CONECT   36   37   38   39
CONECT   37   87   88   89
CONECT   38   90   91   92
CONECT   39   40   93   94
CONECT   40   41   42   95
CONECT   41   96
CONECT   42   97   98
END
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SMILES for HMDB0002789 (Zeaxanthin)

C\C(\C=C\C=C(/C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C
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INCHI for HMDB0002789 (Zeaxanthin)

InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1
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View in JSmolView Stereo Labels
Synonyms
ValueSource
(3R,3'r)-Dihydroxy-beta,beta-caroteneChEBI
all-trans-beta-Carotene-3,3'-diolChEBI
all-trans-ZeaxanthinChEBI
AnchovyxanthinChEBI
beta,beta-Carotene-3,3'-diolChEBI
(3R,3'r)-beta,beta-Carotene-3,3'-diolKegg
(3R,3'r)-Dihydroxy-b,b-caroteneGenerator
(3R,3'r)-Dihydroxy-β,β-caroteneGenerator
all-trans-b-Carotene-3,3'-diolGenerator
all-trans-Β-carotene-3,3'-diolGenerator
b,b-Carotene-3,3'-diolGenerator
Β,β-carotene-3,3'-diolGenerator
(3R,3'r)-b,b-Carotene-3,3'-diolGenerator
(3R,3'r)-Β,β-carotene-3,3'-diolGenerator
3R,3'r ZeaxanthinMeSH
3R,3'r-ZeaxanthinMeSH
Beta Carotene 3,3' diolMeSH
ZeaxanthinsMeSH
beta-Carotene-3,3'-diolMeSH
(3R,3'r)-ZeaxanthinHMDB
all-trans-AnchovyxanthinHMDB
Xanthophyll 3HMDB
ZeaxantholHMDB
(3R,3'R)-Dihydroxy-beta-caroteneHMDB
(3R,3'R)-Dihydroxy-β-caroteneHMDB
(3R,3'R)-ZeaxanthinHMDB
(3R,3’R)-Dihydroxy-β-caroteneHMDB
(3R,3’R)-ZeaxanthinHMDB
(3R,3’R)-β,β-Carotene-3,3’-diolHMDB
all-E-ZeaxanthinHMDB
all-trans-3R,3'R-ZeaxanthinHMDB
all-trans-3R,3’R-ZeaxanthinHMDB
Chemical FormulaC40H56O2
Average Molecular Weight568.886
Monoisotopic Molecular Weight568.428031043
IUPAC Name(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-3,5,5-trimethylcyclohex-3-en-1-ol
Traditional Namezeaxanthin
CAS Registry Number144-68-3
SMILES
C\C(\C=C\C=C(/C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C
InChI Identifier
InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1
InChI KeyJKQXZKUSFCKOGQ-QAYBQHTQSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as xanthophylls. These are carotenoids containing an oxygenated carotene backbone. Carotenes are characterized by the presence of two end-groups (mostly cyclohexene rings, but also cyclopentene rings or acyclic groups) linked by a long branched alkyl chain. Carotenes belonging form a subgroup of the carotenoids family. Xanthophylls arise by oxygenation of the carotene backbone.
KingdomOrganic compounds
Super ClassLipids and lipid-like molecules
ClassPrenol lipids
Sub ClassTetraterpenoids
Direct ParentXanthophylls
Alternative Parents
Substituents
  • Xanthophyll
  • Secondary alcohol
  • Organic oxygen compound
  • Hydrocarbon derivative
  • Organooxygen compound
  • Alcohol
  • Aliphatic homomonocyclic compound
Molecular FrameworkAliphatic homomonocyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological locationRoute of exposureSource
Process
Naturally occurring process
Role
Biological roleIndustrial application
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point215.5 °CNot Available
Boiling PointNot AvailableNot Available
Water Solubility4.4e-11 mg/L @ 25 °C (est)The Good Scents Company Information System
LogP14.950 (est)The Good Scents Company Information System
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility0.00065 g/LALOGPS
logP8.3ALOGPS
logP8.35ChemAxon
logS-5.9ALOGPS
pKa (Strongest Acidic)18.91ChemAxon
pKa (Strongest Basic)-0.79ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count2ChemAxon
Polar Surface Area40.46 ŲChemAxon
Rotatable Bond Count10ChemAxon
Refractivity194.95 m³·mol⁻¹ChemAxon
Polarizability73.47 ųChemAxon
Number of Rings2ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+264.33430932474
DeepCCS[M-H]-262.43930932474
DeepCCS[M-2H]-296.08230932474
DeepCCS[M+Na]+270.01630932474
AllCCS[M+H]+259.332859911
AllCCS[M+H-H2O]+257.732859911
AllCCS[M+NH4]+260.932859911
AllCCS[M+Na]+261.332859911
AllCCS[M-H]-231.232859911
AllCCS[M+Na-2H]-234.932859911
AllCCS[M+HCOO]-239.032859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
ZeaxanthinC\C(\C=C\C=C(/C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C6200.6Standard polar33892256
ZeaxanthinC\C(\C=C\C=C(/C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C4801.7Standard non polar33892256
ZeaxanthinC\C(\C=C\C=C(/C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C4417.5Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Zeaxanthin,1TMS,isomer #1CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O[Si](C)(C)C)CC2(C)C)C(C)(C)C[C@H](O)C14759.2Semi standard non polar33892256
Zeaxanthin,2TMS,isomer #1CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O[Si](C)(C)C)CC2(C)C)C(C)(C)C[C@H](O[Si](C)(C)C)C14696.7Semi standard non polar33892256
Zeaxanthin,1TBDMS,isomer #1CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O[Si](C)(C)C(C)(C)C)CC2(C)C)C(C)(C)C[C@H](O)C14957.1Semi standard non polar33892256
Zeaxanthin,2TBDMS,isomer #1CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O[Si](C)(C)C(C)(C)C)CC2(C)C)C(C)(C)C[C@H](O[Si](C)(C)C(C)(C)C)C15117.6Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Zeaxanthin GC-MS (Non-derivatized) - 70eV, Positivesplash10-0udi-2000190000-2cc8481518a3532682532017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Zeaxanthin GC-MS (1 TMS) - 70eV, Positivesplash10-004i-3000049000-45b1b78e4b208f89e4572017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Zeaxanthin GC-MS ("Zeaxanthin,1TMS,#1" TMS) - 70eV, PositiveNot Available2021-10-14Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Zeaxanthin GC-MS (TMS_2_1) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Zeaxanthin GC-MS (TBDMS_1_1) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Zeaxanthin GC-MS (TBDMS_2_1) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin QIT 20V, positive-QTOFsplash10-0xsi-0000490000-61514ff28dff7d7222e12020-07-21HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin QIT 1V, positive-QTOFsplash10-0udi-0000290000-09f7ca5714961ff8f77e2020-07-21HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin NA , positive-QTOFsplash10-00or-0930100000-c29159f503dad4260c042020-07-21HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin LC-ESI-QTOF 20V, positive-QTOFsplash10-00or-0960430000-8996d3474c2f84178dd02020-07-21HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin LC-ESI-QTOF 30V, positive-QTOFsplash10-0aba-0930000000-8b9aa98251b44f2236fa2020-07-21HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin LC-ESI-QTOF 40V, positive-QTOFsplash10-014i-0930030000-987a65a5fdcee38163382020-07-21HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 30V, Positive-QTOFsplash10-0aba-0930000000-b50e7afd480c604277302021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 20V, Positive-QTOFsplash10-00or-0950320000-82e2fd12101c0f8a5aa32021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 20V, Positive-QTOFsplash10-00or-0950420000-376dfbe507c212fad75c2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 40V, Positive-QTOFsplash10-014i-0930030000-7a03386b81c0af2daaae2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 30V, Positive-QTOFsplash10-0aba-0930000000-63535133943f458f56192021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 40V, Positive-QTOFsplash10-014i-0930030000-18da3552a389eec494702021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 20V, Positive-QTOFsplash10-00or-0950420000-97b603fc0db5c5d1268c2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 30V, Positive-QTOFsplash10-0aba-0930000000-a5be07cc9aa560c7ad052021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 30V, Positive-QTOFsplash10-0aba-0930000000-247f26afe81a420dd3292021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Zeaxanthin 20V, Positive-QTOFsplash10-00or-0950320000-a6da820e1ac88487b3542021-09-20HMDB team, MONAView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 10V, Positive-QTOFsplash10-0gb9-0111190000-a3e4a4d0d67ea298da492016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 20V, Positive-QTOFsplash10-0frt-0649330000-191e0ac14dcad154b4b32016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 40V, Positive-QTOFsplash10-000b-0449130000-5644e7cc2bbfa6ef09f02016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 10V, Negative-QTOFsplash10-014i-0000090000-8f8c6909e2b7e1022ce92016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 20V, Negative-QTOFsplash10-014i-0000090000-421f46802deab60d756d2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 40V, Negative-QTOFsplash10-0uxr-0553390000-883720ed84543eb475e22016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 10V, Negative-QTOFsplash10-014i-0001090000-762864ffd0f72009c6882021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 20V, Negative-QTOFsplash10-014i-0104290000-79f130816293d1629a5c2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Zeaxanthin 40V, Negative-QTOFsplash10-003b-0229210000-8aa487c6a883739666a22021-09-22Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Extracellular
  • Membrane (predicted from logP)
Biospecimen Locations
  • Blood
Tissue Locations
  • Adipose Tissue
  • Eye Lens
  • Retina
  • Spleen
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodDetected and Quantified0.22 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.25 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.114 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.382 +/- 0.00600 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.310 +/- 0.110 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.320 +/- 0.100 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.390 +/- 0.180 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.400 +/- 0.180 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.153 +/- 0.160 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.360 +/- 0.160 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.560 +/- 0.270 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.139 +/- 0.130 uMAdult (>18 years old)Male
Normal		 details
BloodDetected and Quantified0.350 +/- 0.130 uMAdult (>18 years old)Male
Normal		 details
BloodDetected and Quantified0.350 +/- 0.140 uMAdult (>18 years old)Male
Normal		 details
BloodDetected and Quantified0.520 +/- 0.230 uMAdult (>18 years old)Male
Normal		 details
BloodDetected and Quantified0.163 +/- 0.190 uMAdult (>18 years old)Not Specified
Normal		 details
BloodDetected and Quantified0.438 +/- 0.161 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.374 +/- 0.150 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.493 +/- 0.181 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.399 +/- 0.121 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.290 +/- 0.120 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.390 +/- 0.140 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.480 +/- 0.180 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.26 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.26 uMAdult (>18 years old)Male
Normal		 details
BloodDetected and Quantified460 +/- 150 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.329 +/- 0.139 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.341 +/- 0.168 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.24 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.032 +/- 0.023 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.27 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.128 uMAdult (>18 years old)Both
Normal		 details
BloodDetected and Quantified0.305 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.445 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.47 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.36 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.384 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.436 uMAdult (>18 years old)Female
Normal		 details
BloodDetected and Quantified0.0344 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.039 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.0530 +/- 0.0200 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.0680 +/- 0.0400 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.299 +/- 0.123 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.316 +/- 0.109 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.360 +/- 0.450 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.394 +/- 0.179 uMAdult (>18 years old)BothNormal details
BloodDetected and Quantified0.09 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.32 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.33 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.395 uMAdolescent (13-18 years old)FemaleNormal details
BloodDetected and Quantified0.401 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.492 uMChildren (1-13 years old)FemaleNormal details
BloodDetected and Quantified0.0600 +/- 0.0300 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.0850 +/- 0.0340 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.113 +/- 0.0492 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.128 +/- 0.0529 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.216 +/- 0.0861 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.260 +/- 0.0800 uMAdolescent (13-18 years old)FemaleNormal details
BloodDetected and Quantified0.315 +/- 0.128 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.328 +/- 0.165 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.330 +/- 0.0900 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.383 +/- 0.183 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.411 +/- 0.140 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.432 +/- 0.204 uMAdult (>18 years old)FemaleNormal details
BloodDetected and Quantified0.09 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.3 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.32 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.413 uMAdolescent (13-18 years old)MaleNormal details
BloodDetected and Quantified0.498 uMChildren (1-13 years old)MaleNormal details
BloodDetected and Quantified0.0390 +/- 0.0150 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.0660 +/- 0.0280 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.0700 +/- 0.0300 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.240 +/- 0.0700 uMAdolescent (13-18 years old)MaleNormal details
BloodDetected and Quantified0.251 +/- 0.111 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.269 +/- 0.123 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.278 +/- 0.118 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.316 +/- 0.143 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.367 +/- 0.176 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified420 +/- 140 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified490 +/- 190 uMAdult (>18 years old)MaleNormal details
BloodDetected and Quantified0.04 +/- 0.04 uMAdult (>18 years old)BothNormal details
Abnormal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodDetected and Quantified0.126 +/- 0.110 uMAdult (>18 years old)Not Specified
Obese		 details
BloodDetected and Quantified0.157 +/- 0.160 uMAdult (>18 years old)Not Specified
Overweight		 details
BloodDetected and Quantified0.0700 +/- 0.0300 uMAdult (>18 years old)BothType I diabetes details
Associated Disorders and Diseases
Disease References
Obesity
  1. Vioque J, Weinbrenner T, Asensio L, Castello A, Young IS, Fletcher A: Plasma concentrations of carotenoids and vitamin C are better correlated with dietary intake in normal weight than overweight and obese elderly subjects. Br J Nutr. 2007 May;97(5):977-86. [PubMed:17408529 ]
Diabetes mellitus type 1
  1. Granado-Lorencio F, Olmedilla-Alonso B, Blanco-Navarro I, Botella-Romero F, Simal-Anton A: Assessment of carotenoid status and the relation to glycaemic control in type I diabetics: a follow-up study. Eur J Clin Nutr. 2006 Aug;60(8):1000-8. Epub 2006 Feb 1. [PubMed:16452910 ]
Associated OMIM IDs
DrugBank IDDB11176
Phenol Explorer Compound IDNot Available
FooDB IDFDB023113
KNApSAcK IDC00000931
Chemspider ID4444421
KEGG Compound IDC06098
BioCyc IDCPD1F-130
BiGG IDNot Available
Wikipedia LinkZeaxanthin
METLIN IDNot Available
PubChem Compound5280899
PDB IDNot Available
ChEBI ID27547
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDMDB00000401
Good Scents IDrw1416271
References
Synthesis ReferencePaus, Joachim; Kriegl, Wolfgang. Process for the preparation of zeaxanthin and its intermediates. Eur. Pat. Appl. (1998), 19 pp.
Material Safety Data Sheet (MSDS)Download (PDF)
General References
  1. Wenzel AJ, Gerweck C, Barbato D, Nicolosi RJ, Handelman GJ, Curran-Celentano J: A 12-wk egg intervention increases serum zeaxanthin and macular pigment optical density in women. J Nutr. 2006 Oct;136(10):2568-73. [PubMed:16988128 ]
  2. Rapp LM, Maple SS, Choi JH: Lutein and zeaxanthin concentrations in rod outer segment membranes from perifoveal and peripheral human retina. Invest Ophthalmol Vis Sci. 2000 Apr;41(5):1200-9. [PubMed:10752961 ]
  3. Khachik F, Bernstein PS, Garland DL: Identification of lutein and zeaxanthin oxidation products in human and monkey retinas. Invest Ophthalmol Vis Sci. 1997 Aug;38(9):1802-11. [PubMed:9286269 ]
  4. Handelman GJ, Nightingale ZD, Lichtenstein AH, Schaefer EJ, Blumberg JB: Lutein and zeaxanthin concentrations in plasma after dietary supplementation with egg yolk. Am J Clin Nutr. 1999 Aug;70(2):247-51. [PubMed:10426702 ]
  5. Dasch B, Fuhs A, Schmidt J, Behrens T, Meister A, Wellmann J, Fobker M, Pauleikhoff D, Hense HW: Serum levels of macular carotenoids in relation to age-related maculopathy: the Muenster Aging and Retina Study (MARS). Graefes Arch Clin Exp Ophthalmol. 2005 Oct;243(10):1028-35. Epub 2005 Oct 20. [PubMed:15909159 ]
  6. Bone RA, Landrum JT, Friedes LM, Gomez CM, Kilburn MD, Menendez E, Vidal I, Wang W: Distribution of lutein and zeaxanthin stereoisomers in the human retina. Exp Eye Res. 1997 Feb;64(2):211-8. [PubMed:9176055 ]
  7. Chitchumroonchokchai C, Failla ML: Hydrolysis of zeaxanthin esters by carboxyl ester lipase during digestion facilitates micellarization and uptake of the xanthophyll by Caco-2 human intestinal cells. J Nutr. 2006 Mar;136(3):588-94. [PubMed:16484529 ]
  8. Khachik F: An efficient conversion of (3R,3'R,6'R)-lutein to (3R,3'S,6'R)-lutein (3'-epilutein) and (3R,3'R)-zeaxanthin. J Nat Prod. 2003 Jan;66(1):67-72. [PubMed:12542348 ]
  9. Hammond BR Jr, Wooten BR, Snodderly DM: Density of the human crystalline lens is related to the macular pigment carotenoids, lutein and zeaxanthin. Optom Vis Sci. 1997 Jul;74(7):499-504. [PubMed:9293517 ]
  10. Johnson EJ, Hammond BR, Yeum KJ, Qin J, Wang XD, Castaneda C, Snodderly DM, Russell RM: Relation among serum and tissue concentrations of lutein and zeaxanthin and macular pigment density. Am J Clin Nutr. 2000 Jun;71(6):1555-62. [PubMed:10837298 ]
  11. Mares-Perlman JA, Millen AE, Ficek TL, Hankinson SE: The body of evidence to support a protective role for lutein and zeaxanthin in delaying chronic disease. Overview. J Nutr. 2002 Mar;132(3):518S-524S. [PubMed:11880585 ]
  12. Sies H, Stahl W: Non-nutritive bioactive constituents of plants: lycopene, lutein and zeaxanthin. Int J Vitam Nutr Res. 2003 Mar;73(2):95-100. [PubMed:12747216 ]
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