John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=HPRvK6tAOc9 SpectraBase Spectrum ID=8kFF0gvvQnm

(accessed ).
LEUPYRRIN-B2
SpectraBase Compound ID HPRvK6tAOc9
InChI InChI=1S/C41H54N2O10/c1-23(2)16-27-18-35(45)52-37-36(53-40(47)41(37,7)22-44)26(6)11-12-28-13-14-31(42-28)38-43-32(34(51-38)21-50-39(27)46)19-29-30(25(5)10-9-15-48-8)20-49-33(29)17-24(3)4/h9-11,13-14,18-19,23-24,32-34,36-37,42,44H,12,15-17,20-22H2,1-8H3/b10-9+,26-11+,27-18+,29-19-,30-25+
InChIKey SRCDTOUUBIJABY-GREQVZGHSA-N
Mol Weight 734.9 g/mol
Molecular Formula C41H54N2O10
Exact Mass 734.377846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8kFF0gvvQnm
Name LEUPYRRIN-B2
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H54N2O10
InChI InChI=1S/C41H54N2O10/c1-23(2)16-27-18-35(45)52-37-36(53-40(47)41(37,7)22-44)26(6)11-12-28-13-14-31(42-28)38-43-32(34(51-38)21-50-39(27)46)19-29-30(25(5)10-9-15-48-8)20-49-33(29)17-24(3)4/h9-11,13-14,18-19,23-24,32-34,36-37,42,44H,12,15-17,20-22H2,1-8H3/b10-9+,26-11+,27-18+,29-19-,30-25+
InChIKey SRCDTOUUBIJABY-GREQVZGHSA-N
Literature Reference Author H.B.BODE,H.IRSCHIK,S.C.WENZEL,H.REICHENBACH,R.MUELLER,G.HOEF LE
Literature Reference Citation J.NAT.PROD.,66,1203(2003)
Literature Reference DOI 10.1021/np030109v
Molecular Weight 734.887 g/mol
Solvent CDCl3
Source File Reference UWSP989
SpectraBase Batch ID 4QX7plgqAKg