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2-Butenoic acid, 3-methyl-4-[tetrahydro-3,4-dihydroxy-5-[[3-(2-hydroxy-1-methylpropyl)oxiranyl]methyl]-2H-pyran-2-yl]-, ethyl ester, [2S-[2.alpha.(E),3.beta.,4.beta.,5.alpha.[2R*,3R*(1R*,2R*)]]]-
SpectraBase Compound ID L0qrseaAHDK
InChI InChI=1S/C19H32O7/c1-5-24-16(21)7-10(2)6-14-18(23)17(22)13(9-25-14)8-15-19(26-15)11(3)12(4)20/h7,11-15,17-20,22-23H,5-6,8-9H2,1-4H3/b10-7+
InChIKey KVSTXNJARPQHCO-JXMROGBWSA-N
Mol Weight 372.5 g/mol
Molecular Formula C19H32O7
Exact Mass 372.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8N5MtyEPje4
Name 2-Butenoic acid, 3-methyl-4-[tetrahydro-3,4-dihydroxy-5-[[3-(2-hydroxy-1-methylpropyl)oxiranyl]methyl]-2H-pyran-2-yl]-, ethyl ester, [2S-[2.alpha.(E),3.beta.,4.beta.,5.alpha.[2R*,3R*(1R*,2R*)]]]-
Alternate Name(s) (E)-4-[3,4-dihydroxy-5-[[3-(2-hydroxy-1-methyl-propyl)oxiran-2-yl]methyl]tetrahydropyran-2-yl]-3-methyl-but-2-enoic acid ethyl ester (E)-4-[3,4-dihydroxy-5-[[3-(3-hydroxybutan-2-yl)-2-oxiranyl]methyl]-2-oxanyl]-3-methyl-2-butenoic acid ethyl ester Ethyl (E)-4-[3,4-bis(oxidanyl)-5-[[3-(3-oxidanylbutan-2-yl)oxiran-2-yl]methyl]oxan-2-yl]-3-methyl-but-2-enoate Ethyl (E)-4-[3,4-dihydroxy-5-[[3-(2-hydroxy-1-methyl-propyl)oxiran-2-yl]methyl]tetrahydropyran-2-yl]-3-methyl-but-2-enoate Ethyl (E)-4-[3,4-dihydroxy-5-[[3-(3-hydroxybutan-2-yl)oxiran-2-yl]methyl]oxan-2-yl]-3-methylbut-2-enoate Ethyl monate Ethyl monate A
CAS Registry Number 66262-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O7
InChI InChI=1S/C19H32O7/c1-5-24-16(21)7-10(2)6-14-18(23)17(22)13(9-25-14)8-15-19(26-15)11(3)12(4)20/h7,11-15,17-20,22-23H,5-6,8-9H2,1-4H3/b10-7+
InChIKey KVSTXNJARPQHCO-JXMROGBWSA-N
Molecular Weight 372.458 g/mol
SMILES OC(C(C1OC1CC1C(C(C(OC1)C\C(=C\C(OCC)=O)C)O)O)C)C
SPLASH splash10-004i-0090000000-6ef2b30c355e05b13434
Source of Spectrum KC-1979-311-0
Wiley ID 1355365