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2,5-EPOXY-(2-BETA)-HYDROXY-(4-ALPHA)-METHOXY-(8-ALPHA)-(2-METHYLBUT-2-ENOYLOXY)-2-OXO-4(15),10(14),11(13)-GERMACRATRIEN-12,6-ALPHA-OLIDE

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2,5-EPOXY-(2-BETA)-HYDROXY-(4-ALPHA)-METHOXY-(8-ALPHA)-(2-METHYLBUT-2-ENOYLOXY)-2-OXO-4(15),10(14),11(13)-GERMACRATRIEN-12,6-ALPHA-OLIDE
SpectraBase Compound ID 15ilZCtizlh
InChI InChI=1S/C21H28O7/c1-7-12(3)18(22)26-14-8-11(2)9-21(24)10-20(5,25-6)17(28-21)16-15(14)13(4)19(23)27-16/h7,14-17,24H,2,4,8-10H2,1,3,5-6H3/b12-7+/t14-,15+,16-,17+,20+,21+/m0/s1
InChIKey PDFFFCDISRKSLI-KSIAICTFSA-N
Mol Weight 392.45 g/mol
Molecular Formula C21H28O7
Exact Mass 392.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DHrvk3b5oqb
Name 2,5-EPOXY-(2-BETA)-HYDROXY-(4-ALPHA)-METHOXY-(8-ALPHA)-(2-METHYLBUT-2-ENOYLOXY)-2-OXO-4(15),10(14),11(13)-GERMACRATRIEN-12,6-ALPHA-OLIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O7
InChI InChI=1S/C21H28O7/c1-7-12(3)18(22)26-14-8-11(2)9-21(24)10-20(5,25-6)17(28-21)16-15(14)13(4)19(23)27-16/h7,14-17,24H,2,4,8-10H2,1,3,5-6H3/b12-7+/t14-,15+,16-,17+,20+,21+/m0/s1
InChIKey PDFFFCDISRKSLI-KSIAICTFSA-N
Literature Reference Author T.K.TABOPDA,J.NGOUPAYO,J.LIU,M.S.ALI,S.N.KHAN,B.T.NGADJUI,B. LUU
Literature Reference Citation CHEM.PHARM.BULL.,56,231(2008)
Literature Reference DOI 10.1248/cpb.56.231
Molecular Weight 392.449 g/mol
Sample ID 1301
Solvent CDCl3