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acetic acid [(2R,3S,5R,6S,7R)-7,9-dichloro-3-[[(2E,4E,6R)-4,6-dimethyldodeca-2,4-dienoyl]amino]-8-keto-2-methoxy-1-oxaspiro[4.5]dec-9-en-6-yl] ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

acetic acid [(2R,3S,5R,6S,7R)-7,9-dichloro-3-[[(2E,4E,6R)-4,6-dimethyldodeca-2,4-dienoyl]amino]-8-keto-2-methoxy-1-oxaspiro[4.5]dec-9-en-6-yl] ester
SpectraBase Compound ID 7P99VMOlq1R
InChI InChI=1S/C26H37Cl2NO6/c1-6-7-8-9-10-16(2)13-17(3)11-12-21(31)29-20-15-26(35-25(20)33-5)14-19(27)23(32)22(28)24(26)34-18(4)30/h11-14,16,20,22,24-25H,6-10,15H2,1-5H3,(H,29,31)/b12-11+,17-13+/t16-,20+,22+,24-,25-,26+/m1/s1
InChIKey YYIRWPRKGCMLIO-SZFICAOCSA-N
Mol Weight 530.5 g/mol
Molecular Formula C26H37Cl2NO6
Exact Mass 529.199793 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59HXscB6zGi
Name acetic acid [(2R,3S,5R,6S,7R)-7,9-dichloro-3-[[(2E,4E,6R)-4,6-dimethyldodeca-2,4-dienoyl]amino]-8-keto-2-methoxy-1-oxaspiro[4.5]dec-9-en-6-yl] ester
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H37Cl2NO6
InChI InChI=1S/C26H37Cl2NO6/c1-6-7-8-9-10-16(2)13-17(3)11-12-21(31)29-20-15-26(35-25(20)33-5)14-19(27)23(32)22(28)24(26)34-18(4)30/h11-14,16,20,22,24-25H,6-10,15H2,1-5H3,(H,29,31)/b12-11+,17-13+/t16-,20+,22+,24-,25-,26+/m1/s1
InChIKey YYIRWPRKGCMLIO-SZFICAOCSA-N
Literature Reference Author T.AMAGATA,M.DOI,T.OHTA,K.MINOURA,A.NUMATA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3585(1998)
Literature Reference DOI 10.1039/a804466j
Molecular Weight 530.489 g/mol
Solvent CDCl3
Source File Reference UWCP9055