SpectraBase Compound ID | 9sS5r4BNbZY |
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InChI | InChI=1S/C26H38O4/c1-16(27)9-12-26(3,30-4)24-8-7-22-21-15-23(29)18-13-17(5-6-19(28)14-18)20(21)10-11-25(22,24)2/h5,9,12,15-16,18-20,22,24,27-28H,6-8,10-11,13-14H2,1-4H3/b12-9+/t16-,18+,19+,20-,22+,24?,25+,26-/m1/s1 |
InChIKey | JLTZJSMHAJUVNI-PKRRLDRVSA-N |
Mol Weight | 414.6 g/mol |
Molecular Formula | C26H38O4 |
Exact Mass | 414.27701 g/mol |
SpectraBase Spectrum ID | 8qhvZksGhbM |
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Name | 20-O-METHYLCYCLOCITRINOL |
Compound Number | 4 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C26H38O4 |
InChI | InChI=1S/C26H38O4/c1-16(27)9-12-26(3,30-4)24-8-7-22-21-15-23(29)18-13-17(5-6-19(28)14-18)20(21)10-11-25(22,24)2/h5,9,12,15-16,18-20,22,24,27-28H,6-8,10-11,13-14H2,1-4H3/b12-9+/t16-,18+,19+,20-,22+,24?,25+,26-/m1/s1 |
InChIKey | JLTZJSMHAJUVNI-PKRRLDRVSA-N |
Literature Reference Author | L.DU,T.ZHU,Y.FANG,Q.GU,W.ZHU |
Literature Reference Citation | J.NAT.PROD.,71,1343(2008) |
Literature Reference DOI | 10.1021/np8000442 |
Molecular Weight | 414.585 g/mol |
Sample ID | 28430 |
Solvent | CDCl3 |