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

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

acetic acid [(2R,3S,5R,6S)-8-acetoxy-7,9-dichloro-3-[[(2E,4E,6R)-4,6-dimethyldodeca-2,4-dienoyl]amino]-2-methoxy-1-oxaspiro[4.5]deca-7,9-dien-6-yl] ester
SpectraBase Compound ID A9zrXnDSHsT
InChI InChI=1S/C28H39Cl2NO7/c1-7-8-9-10-11-17(2)14-18(3)12-13-23(34)31-22-16-28(38-27(22)35-6)15-21(29)25(36-19(4)32)24(30)26(28)37-20(5)33/h12-15,17,22,26-27H,7-11,16H2,1-6H3,(H,31,34)/b13-12+,18-14+/t17-,22+,26-,27-,28+/m1/s1
InChIKey WQZJUAIIKWAIFH-QICPMWSLSA-N
Mol Weight 572.5 g/mol
Molecular Formula C28H39Cl2NO7
Exact Mass 571.210358 g/mol
Enantiomer InChIKey WQZJUAIIKWAIFH-LYELANLSSA-N

View Spectrum of acetic acid [(2R,3S,5R,6S)-8-acetoxy-7,9-dichloro-3-[[(2E,4E,6R)-4,6-dimethyldodeca-2,4-dienoyl]amino]-2-methoxy-1-oxaspiro[4.5]deca-7,9-dien-6-yl] ester

MS (GC) Spectrum
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Source of Spectrum KC-0-3596-19

View Spectrum of acetic acid [(2R,3S,5R,6S)-8-acetoxy-7,9-dichloro-3-[[(2E,4E,6R)-4,6-dimethyldodeca-2,4-dienoyl]amino]-2-methoxy-1-oxaspiro[4.5]deca-7,9-dien-6-yl] ester

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • 5,7-Diacetoxygymnastatin B
10-METHOXYCARBONYL-HASTATOSIDE
17-β-hydroxy-19,19-dichloro-5-α,19-cyclo-10-α-androstan-3-one
YUNNANNIN_A
AMENTOL
7-(p-bromobenzoyl)-3-phenylpyrrolo[1,2-c]pyrimidine-5,6-dicarboxylic acid, dimethyl ester
STEREUMIN-E;(3A-R*,4-S*,5-S*,6-R*,8B-S*)-3A,3B,4A,5,5A,6,7,8B-OCTAHYDRO-3,4-DIOXA-1,3B,6-TRIMETHYL-CYCLOPROPA-[A]-PHENALENE-2,8-DIONE
12.beta.-(ethoxyethoxy)picrasan-3.beta.-ol
5-BETA-HYDROXY-CIS-DEHYDROCROTONIN
5-(4-ethoxyphenyl)-3-(3-methoxy-4-propoxyphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione
N-acetylstanozolol
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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