(3R,4S,5R,7S,9R)-3-Hydroxy-9-[(tigloyl)oxy]-Solavetivone

SpectraBase Compound ID	3UEmmH9C2vR
InChI	InChI=1S/C20H28O4/c1-7-12(4)19(23)24-17-9-15(11(2)3)10-20(17)13(5)8-16(21)18(22)14(20)6/h7-8,14-15,17-18,22H,2,9-10H2,1,3-6H3/b12-7+/t14-,15-,17-,18-,20+/m1/s1
InChIKey	PRZHJEFHHOMZQJ-UFXSKVETSA-N Google Search
Mol Weight	332.44 g/mol
Molecular Formula	C20H28O4
Exact Mass	332.198759 g/mol

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SpectraBase Spectrum ID	ItgyWcixMXM
Name	(3R,4S,5R,7S,9R)-3-Hydroxy-9-[(3'-methylbutenoyl)oxy]-Solavetivone
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H28O4
InChI	InChI=1S/C20H28O4/c1-7-12(4)19(23)24-17-9-15(11(2)3)10-20(17)13(5)8-16(21)18(22)14(20)6/h7-8,14-15,17-18,22H,2,9-10H2,1,3-6H3/b12-7+/t14-,15-,17-,18-,20+/m1/s1
InChIKey	PRZHJEFHHOMZQJ-UFXSKVETSA-N
Molecular Weight	332.440 g/mol
SMILES	O[C@]1(C(=O)C=C([C@@]2([C@@]1(C)[H])[C@](OC(\C(=C\C)C)=O)(C[C@](C2)(C(=C)C)[H])[H])C)[H]
SPLASH	splash10-03e9-0059000000-f8463e75aefad6d66d13
Source of Spectrum	G4-61-1518-2
Synonyms	(E)-2-methyl-2-butenoic acid [(2S,4R,5R,6S,7R)-7-hydroxy-6,10-dimethyl-2-(1-methylethenyl)-8-oxo-4-spiro[4.5]dec-9-enyl] ester [(2S,4R,5R,6S,7R)-7-hydroxy-6,10-dimethyl-8-oxo-2-prop-1-en-2-ylspiro[4.5]dec-9-en-4-yl] (E)-2-methylbut-2-enoate [(2S,4R,5R,6S,7R)-7-hydroxy-2-isopropenyl-6,10-dimethyl-8-oxo-spiro[4.5]dec-9-en-4-yl] (E)-2-methylbut-2-enoate [(2S,4R,5R,6S,7R)-6,10-dimethyl-7-oxidanyl-8-oxidanylidene-2-prop-1-en-2-yl-spiro[4.5]dec-9-en-4-yl] (E)-2-methylbut-2-enoate
Wiley ID	1607594