(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid
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![(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b67f59fa351749edb34f76f178c37628.png "(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid")
(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid
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CAS No:
507-61-9
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Formula:
C27H38O4
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Chemical Name:
(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid
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Synonyms:
2,4,6,8,10,12,14-Pentadecaheptaenoic acid,15-[(1R,2R)-1,2-dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-,(2E,4E,6E,8E,10E,12E,14E)-;10′-Apo-β-carotenoic acid,5,6-dihydro-5,6-dihydroxy-;Azafrin;10′-Apo-β,ψ-carotenoic acid,5,6-dihydro-5,6-dihydroxy-,(5R,6R)-;(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid;C.I. 75110;2,4,6,8,10,12,14-Pentadecaheptaenoic acid,15-(1,2-dihydroxy-2,6,6-trimethylcyclohexyl)-4,9,13-trimethyl-,[1R-[1α,1(2E,4E,6E,8E,10E,12E,14E),2β]]-
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CAS No:
(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid Basic Attributes
426.58822
426.59
610-566-6
KTC84VDE1O
Computed Properties
Molecular Weight:426.6
XLogP3:6.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:426.27700969
Monoisotopic Mass:426.27700969
Topological Polar Surface Area:77.8
Heavy Atom Count:31
Complexity:849
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(2E,4E,6E,8E,10E,12E,14E)-15-[(1R,2R)-1,2-Dihydroxy-2,6,6-trimethylcyclohexyl]-4,9,13-trimethyl-2,4,6,8,10,12,14-pentadecaheptaenoic acid
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