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CAPRAZENE
SpectraBase Compound ID BbUPqki0EV5
InChI InChI=1S/C22H31N5O12/c1-25-5-3-8(20(34)35)26(2)18(33)11(25)16(39-21-15(32)12(29)9(7-23)37-21)17-13(30)14(31)19(38-17)27-6-4-10(28)24-22(27)36/h3-4,6,9,11-17,19,21,29-32H,5,7,23H2,1-2H3,(H,34,35)(H,24,28,36)/t9-,11+,12-,13+,14-,15-,16-,17+,19-,21+/m0/s1
InChIKey NNRRJUQQUMBTMH-MDDDJTLCSA-N
Mol Weight 557.51 g/mol
Molecular Formula C22H31N5O12
Exact Mass 557.196921 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ISZaOlGkBh7
Name CAPRAZENE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31N5O12
InChI InChI=1S/C22H31N5O12/c1-25-5-3-8(20(34)35)26(2)18(33)11(25)16(39-21-15(32)12(29)9(7-23)37-21)17-13(30)14(31)19(38-17)27-6-4-10(28)24-22(27)36/h3-4,6,9,11-17,19,21,29-32H,5,7,23H2,1-2H3,(H,34,35)(H,24,28,36)/t9-,11+,12-,13+,14-,15-,16-,17+,19-,21+/m0/s1
InChIKey NNRRJUQQUMBTMH-MDDDJTLCSA-N
Literature Reference Author M.IGARASHI,Y.TAKAHASHI,T.SHITARA,H.NAKAMURA,H.NAGANAWA,T.MIY AKE,Y.AKAMATSU
Literature Reference Citation J.ANTIBIOTICS,58,327(2005)
Literature Reference DOI 10.1038/ja.2005.41
Molecular Weight 557.514 g/mol
Sample ID 54
Solvent D2O