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13-PROPANOYLCHIDIOL

View entire compound with spectra: 1 NMR

13-PROPANOYLCHIDIOL
SpectraBase Compound ID E8ThitOnuwG
InChI InChI=1S/C35H50O9/c1-13-25(36)16(4)30-18(6)29(39)19(7)31(43-30)21(9)32-22(10)34(42-27(37)15-3)24(12)35(40,44-32)23(11)33-20(8)28(38)17(5)26(14-2)41-33/h16,21-24,32,34,40H,13-15H2,1-12H3/t16-,21-,22+,23-,24-,32-,34-,35+/m0/s1
InChIKey UJZUDLBEBDDWIU-GPCQYSETSA-N
Mol Weight 614.8 g/mol
Molecular Formula C35H50O9
Exact Mass 614.345483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3T9HzcPSQJr
Name 13-PROPANOYLCHIDIOL
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H50O9
InChI InChI=1S/C35H50O9/c1-13-25(36)16(4)30-18(6)29(39)19(7)31(43-30)21(9)32-22(10)34(42-27(37)15-3)24(12)35(40,44-32)23(11)33-20(8)28(38)17(5)26(14-2)41-33/h16,21-24,32,34,40H,13-15H2,1-12H3/t16-,21-,22+,23-,24-,32-,34-,35+/m0/s1
InChIKey UJZUDLBEBDDWIU-GPCQYSETSA-N
Literature Reference Author M.CARBONE,M.L.CIAVATTA,J.R.WANG,H.CIRILLO,V.MATHIEU,R.KISS,E .MOLLO,Y.W.GUO,M.GAV
Literature Reference Citation J.NAT.PROD.,76,2065(2013)
Literature Reference DOI 10.1021/np400483c
Molecular Weight 614.777 g/mol
Solvent CDCl3
Source File Reference UWMZ43409