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Entry |
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Classification |
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Carotenoid Name
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β-Damascone;
beta-Damascone
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IUPAC name |
10-Apo-7,8,9,10-tetrahydro-3,4,8,9-tetradehydro-19-nor-beta-caroten-7-one
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Formula |
C13H20O
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Molecular Weight |
192.29 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 |
Odor content of rose oil (Ref.479).
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Number of
conjugated double bonds |
3 including one ketone (3 in total)
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Number of
conjugated multiple bonds |
3 including one ketone (3 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 |
3.521
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Hydrogen Bond donors
(Lipinski's definition) |
0
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Hydrogen Bond Acceptors
(Lipinski's definition) |
1
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| LipinskiFailures |
0
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| Complexity of molecule |
0.176
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| Number of heavy atoms |
14
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TPSA
(Topological Polar Surface Area) |
17.070 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 |
Rosa damascena (Ref.479) - Land plant: Rosaceae: Damask rose (Streptophyta - Rosaceae)Rosa centifolia L. (Ref.479) - Land plant: Rosaceae: Rose de Mai, Burgundy rose (Streptophyta - Rosaceae)
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References |
Ref.479: Rosana Álvarez, Belen Vaz, Hinrich Gronemeyer, and Ángel R. de Lera, Chem Rev. 2014 Jan 8;114(1):1-125. doi: 10.1021/cr400126u. Epub 2013 Nov 22., PMID: 24266866, "Functions, Therapeutic Applications, and Synthesis of Retinoids and Carotenoids".
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CAS |
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Links to other DB |
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