NP-MRD: Showing NP-Card for zeta-carotene (NP0146387)

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Record Information

Version

2.0

Created at

2022-09-02 01:46:41 UTC

Updated at

2022-09-02 01:46:41 UTC

NP-MRD ID

NP0146387

Secondary Accession Numbers

None

Natural Product Identification

Common Name

zeta-carotene

Description

7,7',8,8'-Tetrahydrolycopene, also known as zeta-carotene or carotene, zeta, belongs to the class of organic compounds known as carotenes. These are a type of unsaturated hydrocarbons containing eight consecutive isoprene units. They 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. Thus, 7,7',8,8'-tetrahydrolycopene is considered to be an isoprenoid lipid molecule. 7,7',8,8'-Tetrahydrolycopene is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. 7,7',8,8'-Tetrahydrolycopene exists in all living organisms, ranging from bacteria to humans. zeta-carotene is found in Averrhoa carambola, Brassica napus, Calendula officinalis, Chlorella vulgaris, Citrus maxima, Crocus sativus, Lonicera japonica, Prunus armeniaca, Rhodospirillum rubrum, Rosa rugosa and Rosa villosa. zeta-carotene was first documented in 1971 (PMID: 16657570). The all-trans-isomer of zeta-carotene (PMID: 1396714).

Structure

MOL 3D MOL SDF PDB SMILES InChI

            5280788
  Mrv1652304022019372D          

 40 39  0  0  0  0            999 V2000
    4.5079   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9411    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2224    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7977   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6514    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0832    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3659   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7935    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6556   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   17.3687   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  4  1  0  0  0  0
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M  END

     RDKit          3D

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M  END

            5280788
  Mrv1652304022019372D          

 40 39  0  0  0  0            999 V2000
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   20.2267   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2224    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7977   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6514    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0832    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3659   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7935    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6556   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5121    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9369   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3687   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0803    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2224    1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2267   -1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3701    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0844   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3687   -1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0803    1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7949   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6542    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645    1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.7991    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0844   -1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5094    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9397   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2238   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2252    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9383    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5108   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6526   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7962    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9383    1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5108   -1.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3673    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0818   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  9  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  3 11  2  0  0  0  0
  3 16  1  0  0  0  0
  4 12  2  0  0  0  0
  4 15  1  0  0  0  0
  5  7  1  0  0  0  0
  5 11  1  0  0  0  0
  6  8  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
  9 18  1  0  0  0  0
 10 17  1  0  0  0  0
 13 21  1  0  0  0  0
 13 24  2  0  0  0  0
 14 22  1  0  0  0  0
 14 23  2  0  0  0  0
 17 20  2  0  0  0  0
 18 19  2  0  0  0  0
 19 25  1  0  0  0  0
 19 26  1  0  0  0  0
 20 27  1  0  0  0  0
 20 28  1  0  0  0  0
 23 29  1  0  0  0  0
 24 30  1  0  0  0  0
 29 31  2  0  0  0  0
 30 32  2  0  0  0  0
 31 33  1  0  0  0  0
 32 34  1  0  0  0  0
 33 35  2  0  0  0  0
 33 37  1  0  0  0  0
 34 36  2  0  0  0  0
 34 38  1  0  0  0  0
 35 39  1  0  0  0  0
 36 40  1  0  0  0  0
 39 40  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0146387

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(C)=CCC\C(C)=C\CC\C(C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)CC\C=C(/C)CCC=C(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C40H60/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-16,19-22,25-30H,13-14,17-18,23-24,31-32H2,1-10H3/b12-11+,25-15+,26-16+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+

> <INCHI_KEY>
BIWLELKAFXRPDE-WTXAYMOSSA-N

> <FORMULA>
C40H60

> <MOLECULAR_WEIGHT>
540.92

> <EXACT_MASS>
540.469501932

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
100

> <JCHEM_AVERAGE_POLARIZABILITY>
74.10142118268237

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(6E,10E,12E,14E,16E,18E,20E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene

> <ALOGPS_LOGP>
9.38

> <JCHEM_LOGP>
12.655675132666666

> <ALOGPS_LOGS>
-6.21

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
195.57280000000006

> <JCHEM_ROTATABLE_BOND_COUNT>
18

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.37e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
all-trans-zeta-carotene

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 02-APR-20   NONE
TITLE     NULL                                                        
COMPND    MOLECULE:             5280788                               
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   02-APR-20         0                                  
HETATM    1  C   UNK     0       8.415  -0.385   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      39.090   0.385   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      37.757  -0.385   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       9.748   0.385   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      35.089  -0.385   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      12.416   0.385   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      33.755   0.385   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      13.750  -0.385   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       7.081   0.385   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      40.424  -0.385   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      36.423   0.385   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      11.082  -0.385   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      32.422  -0.385   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      15.083   0.385   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       9.748   1.925   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      37.757  -1.925   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      41.758   0.385   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       5.747  -0.385   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       4.414   0.385   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      43.091  -0.385   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      32.422  -1.925   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      15.083   1.925   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      16.417  -0.385   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      31.088   0.385   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       3.080  -0.385   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       4.414   1.925   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      44.425   0.385   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      43.091  -1.925   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      17.751   0.385   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      29.754  -0.385   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      19.084  -0.385   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      28.420   0.385   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      20.418   0.385   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      27.087  -0.385   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      21.752  -0.385   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      25.753   0.385   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      20.418   1.925   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      27.087  -1.925   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      23.086   0.385   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      24.419  -0.385   0.000  0.00  0.00           C+0
CONECT    1    4    9                                                       
CONECT    2    3   10                                                       
CONECT    3    2   11   16                                                  
CONECT    4    1   12   15                                                  
CONECT    5    7   11                                                       
CONECT    6    8   12                                                       
CONECT    7    5   13                                                       
CONECT    8    6   14                                                       
CONECT    9    1   18                                                       
CONECT   10    2   17                                                       
CONECT   11    3    5                                                       
CONECT   12    4    6                                                       
CONECT   13    7   21   24                                                  
CONECT   14    8   22   23                                                  
CONECT   15    4                                                            
CONECT   16    3                                                            
CONECT   17   10   20                                                       
CONECT   18    9   19                                                       
CONECT   19   18   25   26                                                  
CONECT   20   17   27   28                                                  
CONECT   21   13                                                            
CONECT   22   14                                                            
CONECT   23   14   29                                                       
CONECT   24   13   30                                                       
CONECT   25   19                                                            
CONECT   26   19                                                            
CONECT   27   20                                                            
CONECT   28   20                                                            
CONECT   29   23   31                                                       
CONECT   30   24   32                                                       
CONECT   31   29   33                                                       
CONECT   32   30   34                                                       
CONECT   33   31   35   37                                                  
CONECT   34   32   36   38                                                  
CONECT   35   33   39                                                       
CONECT   36   34   40                                                       
CONECT   37   33                                                            
CONECT   38   34                                                            
CONECT   39   35   40                                                       
CONECT   40   36   39                                                       
MASTER        0    0    0    0    0    0    0    0   40    0   78    0
END

View in JSmol

Synonyms

Value	Source
(6E,10E,12E,14E,16E,18E,20E,22E,26E)-2,6,10,14,19,23,27,31-Octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene	ChEBI
zeta-Carotene	ChEBI
Z-Carotene	Generator
Ζ-carotene	Generator
(6E,10Z,12E,14E,16E,18E,20E,22Z,26E)-2,6,10,14,19,23,27,31-Octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene	HMDB
(9-cis,9'-cis)-7,7',8,8'-Tetrahydro-psi,psi-carotene	HMDB
Carotene, zeta	HMDB
zeta Carotene	HMDB
7,7',8,8'-Tetrahydro-ψ,ψ-carotene	HMDB
7,7',8,8'-Tetrahydro-psi,psi-carotene	HMDB
all-trans-Ζ-carotene	HMDB
all-trans-zeta-Carotene	HMDB

Chemical Formula

C₄₀H₆₀

Average Mass

540.9200 Da

Monoisotopic Mass

540.46950 Da

IUPAC Name

(6E,10E,12E,14E,16E,18E,20E,22E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene

Traditional Name

all-trans-zeta-carotene

CAS Registry Number

Not Available

SMILES

CC(C)=CCC\C(C)=C\CC\C(C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)CC\C=C(/C)CCC=C(C)C

InChI Identifier

InChI=1S/C40H60/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-16,19-22,25-30H,13-14,17-18,23-24,31-32H2,1-10H3/b12-11+,25-15+,26-16+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+

InChI Key

BIWLELKAFXRPDE-WTXAYMOSSA-N

Experimental Spectra

Not Available

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 25 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Averrhoa carambola	LOTUS Database	35616633
Brassica napus	LOTUS Database	35616633
Calendula officinalis	LOTUS Database	35616633
Chlorella vulgaris	LOTUS Database	35616633
Citrus maxima	LOTUS Database	35616633
Crocus sativus	LOTUS Database	35616633
Lonicera japonica	LOTUS Database	35616633
Prunus armeniaca	LOTUS Database	35616633
Rhodospirillum rubrum	LOTUS Database	35616633
Rosa rugosa	LOTUS Database	35616633
Rosa villosa	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as carotenes. These are a type of unsaturated hydrocarbons containing eight consecutive isoprene units. They 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.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Tetraterpenoids

Direct Parent

Carotenes

Alternative Parents

Substituents

Carotene
Branched unsaturated hydrocarbon
Unsaturated aliphatic hydrocarbon
Unsaturated hydrocarbon
Olefin
Acyclic olefin
Hydrocarbon
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

zeta-carotene (CHEBI:28068 )
C40 isoprenoids (tetraterpenes) (C05430 )
Carotenoids (C05430 )
C40 isoprenoids (tetraterpenes) (LMPR01070256 )

Physical Properties

State

Not Available

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Predicted Properties

Property	Value	Source
logP	9.38	ALOGPS
logP	12.66	ChemAxon
logS	-6.2	ALOGPS
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	0	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	0 Å²	ChemAxon
Rotatable Bond Count	18	ChemAxon
Refractivity	195.57 m³·mol⁻¹	ChemAxon
Polarizability	74.1 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0036927

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Not Available

Wikipedia Link

Zeta-Carotene

METLIN ID

Not Available

PubChem Compound

5280788

PDB ID

Not Available

ChEBI ID

28068

Good Scents ID

Not Available

References

General References

Hugueney P, Romer S, Kuntz M, Camara B: Characterization and molecular cloning of a flavoprotein catalyzing the synthesis of phytofluene and zeta-carotene in Capsicum chromoplasts. Eur J Biochem. 1992 Oct 1;209(1):399-407. doi: 10.1111/j.1432-1033.1992.tb17302.x. [PubMed:1396714 ]
Burns ER, Buchanan GA, Carter MC: Inhibition of carotenoid synthesis as a mechanism of action of amitrole, dichlormate, and pyriclor. Plant Physiol. 1971 Jan;47(1):144-8. doi: 10.1104/pp.47.1.144. [PubMed:16657570 ]
LOTUS database [Link]

Showing NP-Card for zeta-carotene (NP0146387)

MOL for NP0146387 (zeta-carotene)

3D MOL for NP0146387 (zeta-carotene)

3D SDF for NP0146387 (zeta-carotene)

3D-SDF for NP0146387 (zeta-carotene)

PDB for NP0146387 (zeta-carotene)

3D PDB for NP0146387 (zeta-carotene)

SMILES for NP0146387 (zeta-carotene)

INCHI for NP0146387 (zeta-carotene)

Structure for NP0146387 (zeta-carotene)

3D Structure for NP0146387 (zeta-carotene)