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3-(S)-(1-H-INDOL-3-YLMETHYL)-6-(R)-ISOBUTYL-1-METHYLPIPERAZINE-2,5-DIONE;CYCLO-(D-N-METHYL-LEU-L-TRP)
SpectraBase Compound ID BMbj7vWx6NB
InChI InChI=1S/C18H23N3O2/c1-11(2)8-16-17(22)20-15(18(23)21(16)3)9-12-10-19-14-7-5-4-6-13(12)14/h4-7,10-11,15-16,19H,8-9H2,1-3H3,(H,20,22)/t15-,16+/m0/s1
InChIKey ZXMLGZPFSBKFTE-JKSUJKDBSA-N
Mol Weight 313.4 g/mol
Molecular Formula C18H23N3O2
Exact Mass 313.179027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KqOk6LlMn7S
Name 3-(S)-(1-H-INDOL-3-YLMETHYL)-6-(R)-ISOBUTYL-1-METHYLPIPERAZINE-2,5-DIONE;CYCLO-(D-N-METHYL-LEU-L-TRP)
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H23N3O2
InChI InChI=1S/C18H23N3O2/c1-11(2)8-16-17(22)20-15(18(23)21(16)3)9-12-10-19-14-7-5-4-6-13(12)14/h4-7,10-11,15-16,19H,8-9H2,1-3H3,(H,20,22)/t15-,16+/m0/s1
InChIKey ZXMLGZPFSBKFTE-JKSUJKDBSA-N
Literature Reference Author P.KLAUSMEYER,T.G.MCCLOUD,K.D.TUCKER,J.H.CARDELLINA,R.H.SHOEM AKER
Literature Reference Citation J.NAT.PROD.,68,1300(2005)
Literature Reference DOI 10.1021/np050141k
Molecular Weight 313.400 g/mol
Solvent CD3OD
Source File Reference UWMZ10703