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VIEQUEAMIDE_A;CYCLO-[DHOYA-VAL-1-HMPA-PRO-N-ME-VAL-2-THR]
SpectraBase Compound ID BgdNV0fEhlf
InChI InChI=1S/C42H69N5O10/c1-15-17-18-21-29-42(11,12)41(55)44-30(23(3)4)37(51)46(14)33(25(7)8)40(54)57-34(26(9)16-2)38(52)47-22-19-20-28(47)36(50)45(13)32(24(5)6)35(49)43-31(27(10)48)39(53)56-29/h1,23-34,48H,16-22H2,2-14H3,(H,43,49)(H,44,55)/t26-,27+,28-,29-,30-,31+,32-,33-,34+/m0/s1
InChIKey WRHBDNJXUOKAGU-SGPIQRHISA-N
Mol Weight 804.0 g/mol
Molecular Formula C42H69N5O10
Exact Mass 803.504443 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2t74WblCwGS
Name VIEQUEAMIDE_A;CYCLO-[DHOYA-VAL-1-HMPA-PRO-N-ME-VAL-2-THR]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H69N5O10
InChI InChI=1S/C42H69N5O10/c1-15-17-18-21-29-42(11,12)41(55)44-30(23(3)4)37(51)46(14)33(25(7)8)40(54)57-34(26(9)16-2)38(52)47-22-19-20-28(47)36(50)45(13)32(24(5)6)35(49)43-31(27(10)48)39(53)56-29/h1,23-34,48H,16-22H2,2-14H3,(H,43,49)(H,44,55)/t26-,27+,28-,29-,30-,31+,32-,33-,34+/m0/s1
InChIKey WRHBDNJXUOKAGU-SGPIQRHISA-N
Literature Reference Author P.D.BOUDREAU,T.BYRUM,W.T.LIU,P.C.DORRESTEIN,W.H.GERWICK
Literature Reference Citation J.NAT.PROD.,75,1560(2012)
Literature Reference DOI 10.1021/np300321b
Molecular Weight 804.037 g/mol
Sample ID 41411
Solvent CDCl3