Structure Database (LMSD)
Common Name
Isozeaxanthin
Systematic Name
β,β-Carotene-4,4'-diol
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of Isozeaxanthin
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
GYZWNQLEQAGWGD-DKLMTRRASA-N
InChi (Click to copy)
InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-35-33(5)37(41)25-27-39(35,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-36-34(6)38(42)26-28-40(36,9)10/h11-24,37-38,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+
SMILES (Click to copy)
C1C(C)(C)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(O)CCC2(C)C)=C(C)C(O)C1
References
Comments
Imported from http://carotenoiddb.jp/
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Xipholena punicea
(#114392)
Aves
(#8782)
Novel methoxy-carotenoids from the burgundy-colored plumage of the Pompadour Cotinga Xipholena punicea.,
Arch Biochem Biophys, 2010
Arch Biochem Biophys, 2010
Pubmed ID:
20709013
Rhacophorus bipunctatus
(#191205)
Amphibia
(#8292)
Characterization of carotenoid pigments in amphibian, Rhacophorous bipunctatus
Merismopedia punctata
(#882065)
The carotenoids of blue-green algae,
Phytochemistry, 1971
Phytochemistry, 1971
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
42
Rings
2
Aromatic Rings
Rotatable Bonds
10
Van der Waals Molecular Volume
664.38
Topological Polar Surface Area
40.46
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
logP
11.12
Molar Refractivity
185.20
Admin
Created at
17th Nov 2021
Updated at
2nd Dec 2021