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DIACARNOXIDE_D;(2-S*)-METHYL-2-((3-R*,6-S*)-6-METHYL-((E)-4-METHYL-6-(2,6,6-TRIMETHYLCYCLOHEX-2-ENYL)-HEX-4-ENYL)-1,2-DIOXAN-3-YL)-PROPANOATE

View entire compound with spectra: 1 NMR

DIACARNOXIDE_D;(2-S*)-METHYL-2-((3-R*,6-S*)-6-METHYL-((E)-4-METHYL-6-(2,6,6-TRIMETHYLCYCLOHEX-2-ENYL)-HEX-4-ENYL)-1,2-DIOXAN-3-YL)-PROPANOATE
SpectraBase Compound ID Cw143g90a3q
InChI InChI=1S/C25H42O4/c1-18(12-13-21-19(2)11-9-15-24(21,4)5)10-8-16-25(6)17-14-22(28-29-25)20(3)23(26)27-7/h11-12,20-22H,8-10,13-17H2,1-7H3/b18-12+/t20-,21?,22+,25-/m0/s1
InChIKey GTRMWSMRZUVWBH-CDNXMLBASA-N
Mol Weight 406.6 g/mol
Molecular Formula C25H42O4
Exact Mass 406.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2vNim5g2uka
Name DIACARNOXIDE_D;(2-S*)-METHYL-2-((3-R*,6-S*)-6-METHYL-((E)-4-METHYL-6-(2,6,6-TRIMETHYLCYCLOHEX-2-ENYL)-HEX-4-ENYL)-1,2-DIOXAN-3-YL)-PROPANOATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H42O4
InChI InChI=1S/C25H42O4/c1-18(12-13-21-19(2)11-9-15-24(21,4)5)10-8-16-25(6)17-14-22(28-29-25)20(3)23(26)27-7/h11-12,20-22H,8-10,13-17H2,1-7H3/b18-12+/t20-,21?,22+,25-/m0/s1
InChIKey GTRMWSMRZUVWBH-CDNXMLBASA-N
Literature Reference Author J.DAI,Y.LIU,Y.D.ZHOU,D.G.NAGLE
Literature Reference Citation J.NAT.PROD.,70,130(2007)
Literature Reference DOI 10.1021/np0604883
Molecular Weight 406.606 g/mol
Sample ID 29467
Solvent CDCl3