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Entry |
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Classification |
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Carotenoid Name
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IUPAC name |
16-(3-Hydroxy-3-methylbutyl)-16'-(3-methylbut-2-enyl)-7,8,11,12,15,7',8',11',12',15'-decahydro-psi,psi-carotene
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Formula |
C50H84O
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Molecular Weight |
701.172 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
7,8+H, 11,12+H, 15,15'+H, 7',8'+H, 11',12'+H, psi,psi, 16'-isoprene, 16-isoprene-3-OH
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Biological functions/Properties |
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Number of
conjugated double bonds |
0
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Number of
conjugated multiple bonds |
0
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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 |
17.662
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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 |
0.000
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| Number of heavy atoms |
51
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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 |
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References |
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CAS |
-
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Links to other DB |
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