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Entry |
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Classification |
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Carotenoid Name
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Hydroxyspheroidene;
1'-Hydroxy-1',2'-dihydrospheroidene
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IUPAC name |
1'-Methoxy-3',4'-didehydro-1,2,7,8,1',2'-hexahydro-psi,psi-carotene-1-ol
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Formula |
C41H62O2
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Molecular Weight |
586.906 g/mol
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Structure |
Search similar carotenoids
Mol file
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Carotenoid DB Fingerprints |
Predict biological activities of this carotenoid
3',4'--H, 1,2+H, 7,8+H, 1',2'+H, 1-OH, 1'-Methoxy, psi,psi
( Help )
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Biological functions/Properties |
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Number of
conjugated double bonds |
10
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Number of
conjugated multiple bonds |
10
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Isomers |
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InChI |
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InChIKey |
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Canonical SMILES |
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XLogP |
12.817
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Hydrogen Bond donors
(Lipinski's definition) |
1
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Hydrogen Bond Acceptors
(Lipinski's definition) |
2
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| LipinskiFailures |
2
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| Complexity of molecule |
0.000
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| Number of heavy atoms |
43
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TPSA
(Topological Polar Surface Area) |
29.460 Å2
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Reaction |
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Pathway |
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Major carotenoid information |
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Minor carotenoid information |
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Source organisms |
Rubrivivax gelatinosus (Ref.354) - Betaproteobacteria: phototrophic purple nonsulfur bacteria (Betaproteobacteria - Unclassified Burkholderiales)Rhodospirillum rubrum (Ref.547) - Alphaproteobacteria: phototrophic purple non-sulfur bacteria (Alphaproteobacteria - Rhodospirillaceae)
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References |
Ref.354: Jirsakova, Vladimira; Reiss-Husson, Francoise; van Dijk, Bas; Owen, Gabrielle; Hoff, Arnold J., Photochemistry and Photobiology (1996), 64(2), 363-368., "Characterization of carotenoid triplet states in the light-harvesting complex B800-850 from the purple bacterium Rubrivivax gelatinosus".
Ref.547: B. H. Davies, Biochem. J. (1970) 116, 101-110, "Alternative Pathways of Spirilloxanthin Biosynthesis in Rhodospirillum rubrum".
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CAS |
1191-20-4
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Links to other DB |
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