Entry |
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Classification |
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Carotenoid Name
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IUPAC name |
(3R)-3',4',7',8'-Tetradehydro-beta,beta-caroten-3-ol
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Formula |
C40H52O
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Molecular Weight |
548.816 g/mol
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Structure |
Search similar carotenoids

Mol file
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Carotenoid DB Fingerprints |
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Biological functions/Properties |
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Number of conjugated double bonds |
9 and 2 (11 in total)
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Number of conjugated multiple bonds |
12
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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 |
12.501
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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 |
1
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Complexity of molecule |
0.323
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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 |
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References |
Ref.45: A. Fiksdahl, T. Bjoernland, and S. Liaaen-Jensen, Phytochemistry, Vol. 23, No.3, pp. 649-655, 1984, "Algal carotenoids with novel end groups".
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CAS |
91298-11-2
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Links to other DB |
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