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VALINOCTIN-B;N-(6-METHYL-3-AMINO-2-HYDROXYOCTANOYL)-VALINE
SpectraBase Compound ID 5tfde2l01ab
InChI InChI=1S/C14H28N2O4/c1-5-9(4)6-7-10(15)12(17)13(18)16-11(8(2)3)14(19)20/h8-12,17H,5-7,15H2,1-4H3,(H,16,18)(H,19,20)/t9?,10-,11+,12+/m1/s1
InChIKey VLUDHYVPNMGNDL-WSWARRKISA-N
Mol Weight 288.39 g/mol
Molecular Formula C14H28N2O4
Exact Mass 288.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59fJuWQH1IW
Name VALINOCTIN-B;N-(6-METHYL-3-AMINO-2-HYDROXYOCTANOYL)-VALINE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H28N2O4
InChI InChI=1S/C14H28N2O4/c1-5-9(4)6-7-10(15)12(17)13(18)16-11(8(2)3)14(19)20/h8-12,17H,5-7,15H2,1-4H3,(H,16,18)(H,19,20)/t9?,10-,11+,12+/m1/s1
InChIKey VLUDHYVPNMGNDL-WSWARRKISA-N
Literature Reference Author R.SEKIZAWA,N.IINUMA,Y.MURAOKA,H.NAGANAWA,N.KINOSHITA,H.NAKAM URA,M.HAMADA,T.TAKEU
Literature Reference Citation J.NAT.PROD.,59,232(1996)
Literature Reference DOI 10.1021/np960067t
Molecular Weight 288.387 g/mol
Solvent CD3OD
Source File Reference UWVP2635