SpectraBase Compound ID | 8JQ1dXobPdK |
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InChI | InChI=1S/C49H74O4/c1-36(2)20-13-21-37(3)22-14-23-38(4)24-15-25-39(5)26-16-27-40(6)28-17-29-41(7)30-18-31-42(8)32-19-33-43(9)34-35-45-44(10)46(50)48(52-11)49(53-12)47(45)51/h20,22,24,26,28,30,32,34H,13-19,21,23,25,27,29,31,33,35H2,1-12H3/b37-22+,38-24+,39-26+,40-28+,41-30+,42-32+,43-34- |
InChIKey | ICFIZJQGJAJRSU-LMBVCTITSA-N |
Mol Weight | 727.1 g/mol |
Molecular Formula | C49H74O4 |
Exact Mass | 726.558711 g/mol |
SpectraBase Spectrum ID | 2rRoY7oPpHi |
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Name | Coenzyme Q8 |
CAS Registry Number | 2394-68-5 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C49H74O4 |
InChI | InChI=1S/C49H74O4/c1-36(2)20-13-21-37(3)22-14-23-38(4)24-15-25-39(5)26-16-27-40(6)28-17-29-41(7)30-18-31-42(8)32-19-33-43(9)34-35-45-44(10)46(50)48(52-11)49(53-12)47(45)51/h20,22,24,26,28,30,32,34H,13-19,21,23,25,27,29,31,33,35H2,1-12H3/b37-22+,38-24+,39-26+,40-28+,41-30+,42-32+,43-34- |
InChIKey | ICFIZJQGJAJRSU-LMBVCTITSA-N |
Molecular Weight | 727.127 g/mol |
SMILES | C1(=C(C(=O)C(=C(C1=O)C\C=C/(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C)C)C)C)C)OC)OC |
SPLASH | splash10-014i-9300100000-8144603c98ae740d94da |
Source of Spectrum | J-45-4103-0 |
Synonyms | COQ8 Ubiquinone 40 Ubiquinone 8 Ubiquinone Q8 |
Wiley ID | 1415826 |