Methyl 12(R),13(S)-epoxy-11(R)-[(p-bromobenzoyl)oxy]-9(Z),15(Z)-octadecadienoate

SpectraBase Compound ID	Csfg4VEVzUF
InChI	InChI=1S/C26H35BrO5/c1-3-4-10-13-22-25(31-22)23(32-26(29)20-16-18-21(27)19-17-20)14-11-8-6-5-7-9-12-15-24(28)30-2/h4,10-11,14,16-19,22-23,25H,3,5-9,12-13,15H2,1-2H3/b10-4-,14-11-/t22-,23+,25+/m0/s1
InChIKey	BXMZKLIDOGOEDN-CCQFSUMLSA-N Google Search
Mol Weight	507.5 g/mol
Molecular Formula	C26H35BrO5
Exact Mass	506.166787 g/mol

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SpectraBase Spectrum ID	3bBLITvkURV
Name	Methyl 12(R),13(S)-epoxy-11(R)-[(p-bromobenzoyl)oxy]-9(Z),15(Z)-octadecadienoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H35BrO5
InChI	InChI=1S/C26H35BrO5/c1-3-4-10-13-22-25(31-22)23(32-26(29)20-16-18-21(27)19-17-20)14-11-8-6-5-7-9-12-15-24(28)30-2/h4,10-11,14,16-19,22-23,25H,3,5-9,12-13,15H2,1-2H3/b10-4-,14-11-/t22-,23+,25+/m0/s1
InChIKey	BXMZKLIDOGOEDN-CCQFSUMLSA-N
Molecular Weight	507.465 g/mol
SMILES	[C@@]1(O[C@]1(C\C=C/CC)[H])([C@](OC(c1ccc(cc1)Br)=O)(\C=C/CCCCCCCC(=O)OC)[H])[H]
SPLASH	splash10-0540-8900000000-7e08570f1b6c8671cfcb
Source of Spectrum	X2-56-257-13
Synonyms	(1R,2Z)-11-methoxy-11-oxo-1-{(2R,3S)-3-[(2Z)-2-pentenyl]oxiranyl}-2-undecenyl 4-bromobenzoate Methyl 12(S),13(S)-epoxy-11(R)-[(p-bromobenzoyl)oxy]-9(Z),15(Z)-octadecadienoate
Wiley ID	1604713