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Isosteviol methyl ester
SpectraBase Compound ID L3Vsb027uZU
InChI InChI=1S/C21H32O3/c1-18-10-6-15-19(2)8-5-9-20(3,17(23)24-4)14(19)7-11-21(15,13-18)12-16(18)22/h14-15H,5-13H2,1-4H3/t14?,15?,18?,19-,20+,21?/m0/s1
InChIKey WWTGKEKQZGKXDC-NSLIZGGESA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qRl6wJI4ck
Name Isosteviol methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-18-10-6-15-19(2)8-5-9-20(3,17(23)24-4)14(19)7-11-21(15,13-18)12-16(18)22/h14-15H,5-13H2,1-4H3/t14?,15?,18?,19-,20+,21?/m0/s1
InChIKey WWTGKEKQZGKXDC-NSLIZGGESA-N
Molecular Weight 332.484 g/mol
SMILES C123C([C@]4(CCC[C@](C4CC3)(C(=O)OC)C)C)CCC(C2)(C)C(C1)=O
SPLASH splash10-05fu-8943000000-96f0fb4040a2946943d0
Source of Spectrum KO-15-214-14
Synonyms Methyl (4alpha,10beta)-16-oxostachan-18-oate Methyl 12-hydroxyatis-16-en-18-oate Methyl ent-16-oxobeyeran-19-oate
Wiley ID 1329806