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Entry |
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Classification |
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Carotenoid Name
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Fucoxanthinol 3'-sulphate
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IUPAC name |
Sodium (3S,5R,6R,3'S,5'R,6'S)-5',6'-epoxy-5,3'-dihydroxy-8-oxo-6,7-didehydro-5,6,5',6',7',8'-hexahydro-beta,beta-caroten-3-yl sulphate
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Formula |
C40H56O8S.Na
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Molecular Weight |
719.908 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
(3S,5R,6R,3'S,5'R,6'S), 6,7--H, 5,6+H, 5',6'+H, 7',8'+H, 5-OH, 3'-OH, 8=O, 5',6'-Epoxy, 3-SO4-Na, beta,beta
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Biological functions/Properties |
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Number of
conjugated double bonds |
9 including one ketone (9 in total)
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Number of
conjugated multiple bonds |
9 including one ketone (9 in total)
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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 |
7.837
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Hydrogen Bond donors
(Lipinski's definition) |
2
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Hydrogen Bond Acceptors
(Lipinski's definition) |
8
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| LipinskiFailures |
2
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| Complexity of molecule |
0.298
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| Number of heavy atoms |
49
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TPSA
(Topological Polar Surface Area) |
144.870 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 |
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References |
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CAS |
213015-32-8, 741657-60-3
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Links to other DB |
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