| SpectraBase Compound ID | 4RX2KgpUZfP |
|---|---|
| InChI | InChI=1S/C51H78O3/c1-40(2)18-10-19-41(3)20-11-21-42(4)22-12-23-43(5)24-13-25-44(6)26-14-27-45(7)28-15-29-46(8)30-16-32-48(39-52)33-17-31-47(9)34-35-49-38-50(53)36-37-51(49)54/h18,20,22,24,26,28,30,33-34,36-38,52-54H,10-17,19,21,23,25,27,29,31-32,35,39H2,1-9H3/b41-20+,42-22+,43-24+,44-26+,45-28+,46-30+,47-34+,48-33- |
| InChIKey | DCKPSTBSMINXNF-MJLXEEGUSA-N |
| Mol Weight | 739.2 g/mol |
| Molecular Formula | C51H78O3 |
| Exact Mass | 738.595096 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E5047pdrEXW |
|---|---|
| Name | 2'-(38-HYDROXY)-NONAPRENYL-1',4'-HYDROQUINONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H78O3 |
| InChI | InChI=1S/C51H78O3/c1-40(2)18-10-19-41(3)20-11-21-42(4)22-12-23-43(5)24-13-25-44(6)26-14-27-45(7)28-15-29-46(8)30-16-32-48(39-52)33-17-31-47(9)34-35-49-38-50(53)36-37-51(49)54/h18,20,22,24,26,28,30,33-34,36-38,52-54H,10-17,19,21,23,25,27,29,31-32,35,39H2,1-9H3/b41-20+,42-22+,43-24+,44-26+,45-28+,46-30+,47-34+,48-33- |
| InChIKey | DCKPSTBSMINXNF-MJLXEEGUSA-N |
| Literature Reference Author | C.ABED,N.LEGRAVE,M.DUFIES,G.ROBERT,V.GUERINEAU,J.VACELET,P.A UBERGER,P.AMADE |
| Literature Reference Citation | MAR.DRUGS,9,1210(2011) |
| Literature Reference DOI | 10.3390/md9071210 |
| Molecular Weight | 739.179 g/mol |
| Source File Reference | UWBT6877 |