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2H-Pyran-3,4-diol, tetrahydro-5-[[3-(2-hydroxy-1-methylpropyl)oxiranyl]methyl]-2-[2-methyl-3-(5-methyl-3-isoxazolyl)-2-propenyl]-, [2S-[2.alpha.(E),3.beta.,4.beta.,5.alpha.[2R*,3R*(1R*, 2R*)]]]-
SpectraBase Compound ID FmmXjboZqPv
InChI InChI=1S/C20H31NO6/c1-10(5-15-7-11(2)27-21-15)6-16-19(24)18(23)14(9-25-16)8-17-20(26-17)12(3)13(4)22/h5,7,12-14,16-20,22-24H,6,8-9H2,1-4H3/b10-5+/t12-,13?,14-,16-,17?,18+,19-,20?/m0/s1
InChIKey QJPCMRXDKKRYOJ-YVQPVFCGSA-N
Mol Weight 381.47 g/mol
Molecular Formula C20H31NO6
Exact Mass 381.215138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9v2rrcJFx8e
Name 2H-Pyran-3,4-diol, tetrahydro-5-[[3-(2-hydroxy-1-methylpropyl)oxiranyl]methyl]-2-[2-methyl-3-(5-methyl-3-isoxazolyl)-2-propenyl]-, [2S-[2.alpha.(E),3.beta.,4.beta.,5.alpha.[2R*,3R*(1R*, 2R*)]]]-
Alternate Name(s) (2S,3R,4R,5S)-5-({3-[(2S)-3-hydroxybutan-2-yl]oxiran-2-yl}methyl)-2-[(2E)-2-methyl-3-(5-methyl-1,2-oxazol-3-yl)prop-2-en-1-yl]oxane-3,4-diol 3-[5-(2,3-epoxy-5-hydroxy-4-metylhexyl)-3,4-dihydroxytetrahydropyran-2-yl]-2-methylprop-1(E)-en-1-yl-5-(3-methyl)isoxazole 5-Methyl-3-normonylisoxazole
CAS Registry Number 89102-75-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO6
InChI InChI=1S/C20H31NO6/c1-10(5-15-7-11(2)27-21-15)6-16-19(24)18(23)14(9-25-16)8-17-20(26-17)12(3)13(4)22/h5,7,12-14,16-20,22-24H,6,8-9H2,1-4H3/b10-5+/t12-,13?,14-,16-,17?,18+,19-,20?/m0/s1
InChIKey QJPCMRXDKKRYOJ-YVQPVFCGSA-N
Molecular Weight 381.469 g/mol
SMILES OC([C@@](C1OC1C[C@]1(CO[C@]([C@@]([C@@]1(O)[H])(O)[H])(C\C(=C\c1noc(c1)C)C)[H])[H])(C)[H])C
SPLASH splash10-000l-9800000000-b2b2b18cc6ca80603cfb
Source of Spectrum KC-1989-2053-2
Wiley ID 1360159