Structure Database (LMSD)
Common Name
Zeaxanthin monomethyl ether
Systematic Name
3'-Methoxy-β,β-caroten-3-ol
Synonyms
- 3-Methoxyzeaxanthin
3D model of Zeaxanthin monomethyl ether
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)
CHXMWPSKJUTLIQ-DGBNVKNUSA-N
InChi (Click to copy)
InChI=1S/C41H58O2/c1-30(18-14-20-32(3)22-24-38-34(5)26-36(42)28-40(38,7)8)16-12-13-17-31(2)19-15-21-33(4)23-25-39-35(6)27-37(43-11)29-41(39,9)10/h12-25,36-37,42H,26-29H2,1-11H3/b13-12+,18-14+,19-15+,24-22+,25-23+,30-16+,31-17+,32-20+,33-21+
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)CC(OC)CC2(C)C)=C(C)CC1O
References
Comments
Imported from http://carotenoiddb.jp/
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Homo sapiens
(#9606)
Mammalia
(#40674)
Identification of 3-methoxyzeaxanthin as a novel age-related carotenoid metabolite in the human macula.,
Invest Ophthalmol Vis Sci, 2007
Invest Ophthalmol Vis Sci, 2007
Pubmed ID:
17389468
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
43
Rings
2
Aromatic Rings
Rotatable Bonds
11
Van der Waals Molecular Volume
681.68
Topological Polar Surface Area
29.46
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
11.77
Molar Refractivity
189.99
Admin
Created at
17th Nov 2021
Updated at
2nd Dec 2021