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(2E,4E,6R)-N-[(3S,5S,6S,7R)-7,9-dichloro-6-hydroxy-2,8-diketo-1-oxaspiro[4.5]dec-9-en-3-yl]-4,6-dimethyl-dodeca-2,4-dienamide

Compound with spectra: 1 NMR, and 1 MS (GC)

(2E,4E,6R)-N-[(3S,5S,6S,7R)-7,9-dichloro-6-hydroxy-2,8-diketo-1-oxaspiro[4.5]dec-9-en-3-yl]-4,6-dimethyl-dodeca-2,4-dienamide
SpectraBase Compound ID AqrdJjVTmHX
InChI InChI=1S/C23H31Cl2NO5/c1-4-5-6-7-8-14(2)11-15(3)9-10-18(27)26-17-13-23(31-22(17)30)12-16(24)20(28)19(25)21(23)29/h9-12,14,17,19,21,29H,4-8,13H2,1-3H3,(H,26,27)/b10-9+,15-11+/t14-,17+,19+,21-,23-/m1/s1
InChIKey METZBVYOQVJJBD-NYNXDBEGSA-N
Mol Weight 472.41 g/mol
Molecular Formula C23H31Cl2NO5
Exact Mass 471.157928 g/mol
Enantiomer InChIKey METZBVYOQVJJBD-FNIRCAPBSA-N

View Spectrum of (2E,4E,6R)-N-[(3S,5S,6S,7R)-7,9-dichloro-6-hydroxy-2,8-diketo-1-oxaspiro[4.5]dec-9-en-3-yl]-4,6-dimethyl-dodeca-2,4-dienamide

MS (GC) Spectrum
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Source of Spectrum KC-0-3597-12

View Spectrum of (2E,4E,6R)-N-[(3S,5S,6S,7R)-7,9-dichloro-6-hydroxy-2,8-diketo-1-oxaspiro[4.5]dec-9-en-3-yl]-4,6-dimethyl-dodeca-2,4-dienamide

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • 1,7-Dioxo-8-chloro-9-hydroxygymnastatin D
(2E,4E,6R)-N-[(3S,5R,6R,7S)-7,9-dichloro-6-hydroxy-2,8-diketo-1-oxaspiro[4.5]dec-9-en-3-yl]-4,6-dimethyl-dodeca-2,4-dienamide
DANKASTATIN_A
2,2-Dimethyl-5,5-dihydroxy-6-(isopentoyl)-8-(3-methyl-2-buten-1-yl)chroman-7-one
BUFYUJCBHCLDNY-XOHKMHQMSA-N
N-(1H-benzimidazol-2-ylmethyl)-5-[4-(3-hydroxyanilino)-1-phthalazinyl]-2-methylbenzenesulfonamide
DEC-9-ENYL-2,3,6-TRI-O-BENZOYL-4-O-(2,3,4,6-TETRA-O-ACETYL-alpha-D-GALAKTOPYRANOSYL)-alpha-D-MANNOPYRANOSE
(4'aS,8'aR)-3',8'a-dimethyl-4'-spiro[1,3-dioxolane-2,6'-5,9-dihydro-4aH-benzo[f]benzofuran]one
Onchitriol I I D
ONCHITRIOL-#2D
trans1-Isopropyl-2-methyl-2-phenyl-1,2-dihydroazeto[2,1-b]quinazoline
Title Journal or Book Year
Absolute stereostructures of novel cytotoxic metabolites, gymnastatins A–E, from a Gymnascella species separated from a Halichondria sponge Journal of the Chemical Society, Perkin Transactions 1 1998
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