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11,13-DIHYDRO-11-ALPHA,13-EPOXYATRIPLICIOLIDE-8-BETA-O-ANGELATE
SpectraBase Compound ID 47SB4AHTADc
InChI InChI=1S/C20H22O8/c1-4-10(2)17(23)26-14-7-19(3)15(22)6-12(28-19)11(8-21)5-13-16(14)20(9-25-20)18(24)27-13/h4-6,13-14,16,21H,7-9H2,1-3H3/b10-4-,11-5-/t13-,14+,16-,19+,20-/m0/s1
InChIKey XPLDQUHNWMTPHP-FREIQQFBSA-N
Mol Weight 390.39 g/mol
Molecular Formula C20H22O8
Exact Mass 390.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSao8EOBB6W
Name 11,13-Dihydro-15-hydroxy-11.alpha.,13-epoxy-tripliciolide
Alternate Name(s) 8.beta.-O-Angelate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O8
InChI InChI=1S/C20H22O8/c1-4-10(2)17(23)26-14-7-19(3)15(22)6-12(28-19)11(8-21)5-13-16(14)20(9-25-20)18(24)27-13/h4-6,13-14,16,21H,7-9H2,1-3H3/b10-4-,11-5-/t13-,14+,16-,19+,20-/m0/s1
InChIKey XPLDQUHNWMTPHP-FREIQQFBSA-N
Molecular Weight 390.388 g/mol
SMILES OC\C=1C=2O[C@](C[C@]([C@]3([C@]4(OC4)C(O[C@]3(C/1)[H])=O)[H])(OC(\C(=C/C)C)=O)[H])(C(C2)=O)C
SPLASH splash10-001i-9101000000-878992e419fd777f2975
Source of Spectrum X2-47-424-6
Wiley ID 1601401