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Entry |
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Classification |
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Carotenoid Name
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12,12'-Diapocarotene-dial
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IUPAC name |
12,12'-Diapo-carotene-12,12'-dial
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Formula |
C10H12O2
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Molecular Weight |
164.196 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 |
5 including two aldehydes (5 in total)
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Number of
conjugated multiple bonds |
5 including two aldehydes (5 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 |
1.074
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Hydrogen Bond donors
(Lipinski's definition) |
0
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Hydrogen Bond Acceptors
(Lipinski's definition) |
2
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| LipinskiFailures |
0
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| Complexity of molecule |
0.000
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| Number of heavy atoms |
12
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TPSA
(Topological Polar Surface Area) |
34.140 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 |
Bixa orellana (Ref.68) - Land plant: Bixaceae (Streptophyta - Bixaceae)
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References |
Ref.68: Haberli, Adrian; Pfander, Hanspeter, Helvetica Chimica Acta (1999), 82(5), 696-706., "Synthesis of bixin and three minor carotenoids from annatto (Bixa orellana)".
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CAS |
5056-17-7
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Links to other DB |
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