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EPICOCCAMIDE_B;5-HYDROXY-1,2-DIMETHYL-4-[2-METHYL-16-(3-O-ACETYL-BETA-D-MANNOPYRANOSYL)-HEXADECANOYL]-1-H-PYRROL-3-(2-H)-ONE

View entire compound with spectra: 1 NMR

EPICOCCAMIDE_B;5-HYDROXY-1,2-DIMETHYL-4-[2-METHYL-16-(3-O-ACETYL-BETA-D-MANNOPYRANOSYL)-HEXADECANOYL]-1-H-PYRROL-3-(2-H)-ONE
SpectraBase Compound ID IvcXlxBD2S8
InChI InChI=1S/C31H53NO10/c1-20(25(35)24-26(36)21(2)32(4)30(24)39)17-15-13-11-9-7-5-6-8-10-12-14-16-18-40-31-28(38)29(41-22(3)34)27(37)23(19-33)42-31/h20-21,23,27-29,31,33,37-39H,5-19H2,1-4H3/t20?,21?,23-,27-,28+,29+,31-/m1/s1
InChIKey JHQOGDPWNIOQFH-BEQXBITGSA-N
Mol Weight 599.8 g/mol
Molecular Formula C31H53NO10
Exact Mass 599.366947 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jla6NCyJKhh
Name EPICOCCAMIDE_B;5-HYDROXY-1,2-DIMETHYL-4-[2-METHYL-16-(3-O-ACETYL-BETA-D-MANNOPYRANOSYL)-HEXADECANOYL]-1-H-PYRROL-3-(2-H)-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H53NO10
InChI InChI=1S/C31H53NO10/c1-20(25(35)24-26(36)21(2)32(4)30(24)39)17-15-13-11-9-7-5-6-8-10-12-14-16-18-40-31-28(38)29(41-22(3)34)27(37)23(19-33)42-31/h20-21,23,27-29,31,33,37-39H,5-19H2,1-4H3/t20?,21?,23-,27-,28+,29+,31-/m1/s1
InChIKey JHQOGDPWNIOQFH-BEQXBITGSA-N
Literature Reference Author H.V.K.WANGUN,H.M.DAHSE,C.HERTWECK
Literature Reference Citation J.NAT.PROD.,70,1800(2007)
Literature Reference DOI 10.1021/np070245q
Molecular Weight 599.763 g/mol
Sample ID 31077
Solvent CDCl3