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Picras-3-en-21-oic acid, 13,20-epoxy-3,11,12-trihydroxy-15-[(5-hydroxy-3,4-dimethyl-1-oxo-2-pentenyl)oxy]-2,16-dioxo-, [11.beta.,12.alpha.,15.beta.(E)]-

Compound with spectra: 1 NMR, and 1 MS (GC)

Picras-3-en-21-oic acid, 13,20-epoxy-3,11,12-trihydroxy-15-[(5-hydroxy-3,4-dimethyl-1-oxo-2-pentenyl)oxy]-2,16-dioxo-, [11.beta.,12.alpha.,15.beta.(E)]-
SpectraBase Compound ID Aw6neNQjcLi
InChI InChI=1S/C28H36O12/c1-11(12(2)9-29)6-17(31)40-20-22-27-10-38-28(22,25(36)37-5)23(34)19(33)21(27)26(4)8-15(30)18(32)13(3)14(26)7-16(27)39-24(20)35/h6,12,14,16,19-23,29,32-34H,7-10H2,1-5H3/b11-6+/t12?,14-,16+,19+,20+,21+,22+,23-,26-,27+,28-/m0/s1
InChIKey WIFFRCHCBNUDBV-GOPQIHQISA-N
Mol Weight 564.6 g/mol
Molecular Formula C28H36O12
Exact Mass 564.220677 g/mol
Enantiomer InChIKey WIFFRCHCBNUDBV-YROQABHMSA-N

View Spectrum of Picras-3-en-21-oic acid, 13,20-epoxy-3,11,12-trihydroxy-15-[(5-hydroxy-3,4-dimethyl-1-oxo-2-pentenyl)oxy]-2,16-dioxo-, [11.beta.,12.alpha.,15.beta.(E)]-

13C NMR Spectrum
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View Spectrum of Picras-3-en-21-oic acid, 13,20-epoxy-3,11,12-trihydroxy-15-[(5-hydroxy-3,4-dimethyl-1-oxo-2-pentenyl)oxy]-2,16-dioxo-, [11.beta.,12.alpha.,15.beta.(E)]-

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum KC-1981-1353-0
  • 2H-3,11c-(Epoxymethano)phenanthro[10,1-bc]pyran, picras-3-en-21-oic acid deriv.
  • Bruceantin-5'-ol
  • Picras-3-en-21-oic acid, 13,20-epoxy-3,11,12-trihydroxy-15-[(5-hydroxy-3,4-dimethyl-1-oxo-2-pentenyl)oxy]-2,16-dioxo-, methyl ester, [11.beta.,12.alpha.,15.beta.(E)]-
  • Methyl 15,16-dihydroxy-3-{[(2E)-5-hydroxy-3,4-dimethyl-2-pentenoyl]oxy}-9,13-dimethyl-4,10,11-trioxo-5,18-dioxapentacyclo[12.5.0.0(1,6).0(2,17).0(8,13)]nonadecane-17-carboxylate
  • MC-31-BC
  • NSC 317018
2H-3,11c-(Epoxymethano)phenanthro[10,1-bc]pyran, picras-3-en-21-oic acid deriv.
2H-3,11c-(Epoxymethano)phenanthro[10,1-bc]pyran, picras-3-en-21-oic acid deriv.
4-Benzyoloxy-2H-3,11c-(Epoxymethano)phenanthro[10,1-bc]pyran, picras-3-en-21-oic acid, methyl ester
Picras-3-en-21-oic acid, 13,20-epoxy-3,11,12-trihydroxy-15-[[3-(2-methyloxiranyl)-1-oxo-2-bute nyl]oxy]-2,16-dioxo-, methyl ester, [11.beta.,12.alpha.,15.beta.(E)]-
Brucein C
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