3-Hydroxy-β,β-carotene-4,4'-dione
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3-Hydroxy-β,β-carotene-4,4'-dione
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CAS No:
4418-72-8
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Formula:
C40H52O3
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Chemical Name:
3-Hydroxy-β,β-carotene-4,4'-dione
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Synonyms:
rac-Adinorubin; (+/-)-9,9'-spirobixanthene-1,1'-diol; Phoenicoxanthin; rac-9,9'-spirobixanthene-1,1'-diol; 9,9'-Spirobi[9H-xanthene]-1,1'-diol;
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CAS No:
Computed Properties
Molecular Weight:580.8
XLogP3:10.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:10
Exact Mass:580.39164552
Monoisotopic Mass:580.39164552
Topological Polar Surface Area:54.4
Heavy Atom Count:43
Complexity:1420
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-Hydroxy-β,β-carotene-4,4'-dione
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