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Entry |
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Classification |
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Carotenoid Name
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Astacein;
Astacin dipalmitate
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IUPAC name |
3,3'-Dihexadecanoyloxy-2,3,2',3'-tetradehydro-beta,beta-carotene-4,4'-dione
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Formula |
C72H110O6
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Molecular Weight |
1071.6 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 |
15 including two ketones and one ester (15 in total)
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Number of
conjugated multiple bonds |
15 including two ketones and one ester (15 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 |
26.220
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Hydrogen Bond donors
(Lipinski's definition) |
0
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Hydrogen Bond Acceptors
(Lipinski's definition) |
6
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| LipinskiFailures |
2
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| Complexity of molecule |
0.160
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| Number of heavy atoms |
78
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TPSA
(Topological Polar Surface Area) |
86.740 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.304: 上野 清, 杉野 目晴貞, 渡邊 成人, 日本化學會誌, Vol. 56 (1935) No. 10 P 1199-1204, "Acanthodiaptomus yamanacensis Brehm (浮游撓脚類(甲殼類)の一種)の色素に就て(第一報)".
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CAS |
579-14-6
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Links to other DB |
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