rel-(1R,2S,4R,5S)-4-Acetoxy-2-[(R)-5-hydroxy-1,5-dimethylhex-3-enyl]-5-methylcyclohexyl (Z)-2-Methylbut-2-enoate

SpectraBase Compound ID	9ZxUQLO8KXJ
InChI	InChI=1S/C22H36O5/c1-8-14(2)21(24)27-20-12-16(4)19(26-17(5)23)13-18(20)15(3)10-9-11-22(6,7)25/h8-9,11,15-16,18-20,25H,10,12-13H2,1-7H3/b11-9-,14-8+/t15-,16+,18+,19-,20-/m1/s1
InChIKey	LHGGSMFQENYPGC-GGVLXXQNSA-N Google Search
Mol Weight	380.5 g/mol
Molecular Formula	C22H36O5
Exact Mass	380.256274 g/mol

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SpectraBase Spectrum ID	Cm1JXwAlNLs
Name	rel-(1R,2S,4R,5S)-4-Acetoxy-2-[(R)-5-hydroxy-1,5-dimethylhex-3-enyl]-5-methylcyclohexyl (Z)-2-Methylbut-2-enoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H36O5
InChI	InChI=1S/C22H36O5/c1-8-14(2)21(24)27-20-12-16(4)19(26-17(5)23)13-18(20)15(3)10-9-11-22(6,7)25/h8-9,11,15-16,18-20,25H,10,12-13H2,1-7H3/b11-9-,14-8+/t15-,16+,18+,19-,20-/m1/s1
InChIKey	LHGGSMFQENYPGC-GGVLXXQNSA-N
Literature Reference DOI	10.1002/cbdv.200690080
Molecular Weight	380.525 g/mol
SMILES	OC(\C=C/C[C@@](C)([C@]1([C@@](C[C@@]([C@@](C1)(OC(=O)C)[H])(C)[H])(OC(\C(=C\C)C)=O)[H])[H])[H])(C)C
SPLASH	splash10-053u-9210000000-da6df55d7bdfee172b9e
Source of Spectrum	CBD-3-789-3
Synonyms	(1R,2S,4R,5S)-4-acetoxy-2-((R,Z)-6-hydroxy-6-methylhept-4-en-2-yl)-5-methylcyclohexyl (E)-2-methylbut-2-enoate
Wiley ID	1790319