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NAGELAMIDE_A
SpectraBase Compound ID 5ioORSKYS3F
InChI InChI=1S/C22H22Br4N10O2/c23-10-6-13(32-17(10)25)19(37)29-4-1-2-12-16(36-22(28)34-12)9(15-8-31-21(27)35-15)3-5-30-20(38)14-7-11(24)18(26)33-14/h1-2,6-9,32-33H,3-5H2,(H,29,37)(H,30,38)(H3,27,31,35)(H3,28,34,36)/b2-1+/t9-/m0/s1
InChIKey QLDOUIZDLPGMQO-VWCDRPFISA-N
Mol Weight 778.1 g/mol
Molecular Formula C22H22Br4N10O2
Exact Mass 773.866072 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I5cv6XGQdWS
Name NAGELAMIDE_A
CAS Registry Number 690627-54-4
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22Br4N10O2
InChI InChI=1S/C22H22Br4N10O2/c23-10-6-13(32-17(10)25)19(37)29-4-1-2-12-16(36-22(28)34-12)9(15-8-31-21(27)35-15)3-5-30-20(38)14-7-11(24)18(26)33-14/h1-2,6-9,32-33H,3-5H2,(H,29,37)(H,30,38)(H3,27,31,35)(H3,28,34,36)/b2-1+/t9-/m0/s1
InChIKey QLDOUIZDLPGMQO-VWCDRPFISA-N
Literature Reference Author T.ENDO,M.TSUDA,T.OKADA,S.MITSUHASHI,H.SHIMA,K.KIKUCHI,Y.MIKA MI,J.FROMONT,J.I.KOB
Literature Reference Citation J.NAT.PROD.,67,1262(2004)
Literature Reference DOI 10.1021/np034077n
Molecular Weight 778.098 g/mol
Solvent DMSO-D6:CF3COOH=99:1
Source File Reference UWMZ7296