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KLYMOLLIN_B

View entire compound with spectra: 1 NMR

KLYMOLLIN_B
SpectraBase Compound ID 4Ej3mmdJlry
InChI InChI=1S/C26H39ClO9/c1-12(2)19-20-21(26(32,11-27)24(34-15(5)29)22(19)33-14(4)28)18-10-13(3)17(31)8-9-25(7,23(20)35-18)36-16(6)30/h12-13,18-24,32H,8-11H2,1-7H3/t13-,18+,19+,20+,21+,22-,23+,24-,25+,26+/m0/s1
InChIKey OMJLKRAICPGFIA-CTRDELQLSA-N
Mol Weight 531.0 g/mol
Molecular Formula C26H39ClO9
Exact Mass 530.228261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9K50j1CPzGi
Name KLYMOLLIN_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H39ClO9
InChI InChI=1S/C26H39ClO9/c1-12(2)19-20-21(26(32,11-27)24(34-15(5)29)22(19)33-14(4)28)18-10-13(3)17(31)8-9-25(7,23(20)35-18)36-16(6)30/h12-13,18-24,32H,8-11H2,1-7H3/t13-,18+,19+,20+,21+,22-,23+,24-,25+,26+/m0/s1
InChIKey OMJLKRAICPGFIA-CTRDELQLSA-N
Literature Reference Author F.J.HSU,B.W.CHEN,Z.H.WEN,C.Y.HUANG,C.F.DAI,J.H.SU,Y.C.WU,J.H .SHEU
Literature Reference Citation J.NAT.PROD.,74,2467(2011)
Literature Reference DOI 10.1021/np200589n
Molecular Weight 531.043 g/mol
Sample ID 39595
Solvent CDCl3