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(+)-N-DEOXYMILITARINONE_A;(+)-CIS-5-(1,4-DIHYDROXYCYCLOHEXYL)-4-DIHYDROXY-3-[(2-E,4-E,6-E)-6,8,10-TRIMETHYL-2,4,6-DODECATRIENOYL]-2-(1-H)-PYRIDINON

View entire compound with spectra: 1 NMR

(+)-N-DEOXYMILITARINONE_A;(+)-CIS-5-(1,4-DIHYDROXYCYCLOHEXYL)-4-DIHYDROXY-3-[(2-E,4-E,6-E)-6,8,10-TRIMETHYL-2,4,6-DODECATRIENOYL]-2-(1-H)-PYRIDINON
SpectraBase Compound ID 3COPdoP8Mpr
InChI InChI=1S/C26H37NO5/c1-5-17(2)14-19(4)15-18(3)8-6-7-9-22(29)23-24(30)21(16-27-25(23)31)26(32)12-10-20(28)11-13-26/h6-9,15-17,19-20,28,32H,5,10-14H2,1-4H3,(H2,27,30,31)/b8-6+,9-7+,18-15+/t17-,19-,20-,26+/m1/s1
InChIKey CFXXFGCOVLKQAW-FOBKFMRFSA-N
Mol Weight 443.6 g/mol
Molecular Formula C26H37NO5
Exact Mass 443.267173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fk0vxc4c4TC
Name (+)-N-DEOXYMILITARINONE_A;(+)-CIS-5-(1,4-DIHYDROXYCYCLOHEXYL)-4-DIHYDROXY-3-[(2-E,4-E,6-E)-6,8,10-TRIMETHYL-2,4,6-DODECATRIENOYL]-2-(1-H)-PYRIDINON
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H37NO5
InChI InChI=1S/C26H37NO5/c1-5-17(2)14-19(4)15-18(3)8-6-7-9-22(29)23-24(30)21(16-27-25(23)31)26(32)12-10-20(28)11-13-26/h6-9,15-17,19-20,28,32H,5,10-14H2,1-4H3,(H2,27,30,31)/b8-6+,9-7+,18-15+/t17-,19-,20-,26+/m1/s1
InChIKey CFXXFGCOVLKQAW-FOBKFMRFSA-N
Literature Reference Author Y.CHENG,B.SCHNEIDER,U.RIESE,B.SCHUBERT,Z.LI,M.HAMBURGER
Literature Reference Citation J.NAT.PROD.,69,436(2006)
Literature Reference DOI 10.1021/np050418g
Molecular Weight 443.583 g/mol
Solvent CD3OD
Source File Reference UWMZ18119