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Entry |
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Classification |
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Carotenoid Name
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(2S,5R,6R)-1,16-didehydro- 2,6-cyclolycopene-5-ol
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IUPAC name |
(2S,5R,6R)-1,2,5,6-Tetrahydro-1,16-didehydro-2,6-cyclo-psi,psi-carotene-5-ol
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Formula |
C40H56O
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Molecular Weight |
552.848 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
(2S,5R,6R), 1,2+H, 5,6+H, 1,16--H, 2,6-cyclo, 5-OH, 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 |
Constitutional isomer: CA01212, CA00070, CA00122, CA00071, CA00149, CA00150, CA00217, CA00231, CA00232, CA00199, CA00198, CA00247, CA00302, CA00304, CA00371, CA00321, CA00322, CA00372, CA00396, CA00398, CA00397, CA00593, CA00595, CA00591, CA00613, CA00594, CA00592, CA00628, CA00629, CA00760
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InChI |
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InChIKey |
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Canonical SMILES |
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XLogP |
12.664
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Hydrogen Bond donors
(Lipinski's definition) |
1
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Hydrogen Bond Acceptors
(Lipinski's definition) |
1
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| LipinskiFailures |
2
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| Complexity of molecule |
0.052
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| Number of heavy atoms |
41
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TPSA
(Topological Polar Surface Area) |
20.230 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 |
Solanum lycopersicum (Ref.318) - Land plant: Solanaceae: tomato, same as Lycopersicon esculentum (Streptophyta - Solanaceae)
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References |
Ref.318: Tadashi YOKOTA, Hideo ETOH, Shunji OSHIMA, Kirou HAYAKAWA and Yukio ISHIGURO, Bioscience, Biotechnology, and Biochemistry, Volume 67, Issue 12, 2003, "Oxygenated Lycopene and Dehydrated Lutein in Tomato Puree".
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CAS |
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Links to other DB |
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