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SAPELIN-E-ACETATE
SpectraBase Compound ID 3dYFNNthqE9
InChI InChI=1S/C32H48O6/c1-18(33)38-26-16-24-28(2,3)25(35)12-14-31(24,7)23-11-13-30(6)20(9-10-22(30)32(23,26)8)19-15-21(34)27(36)29(4,5)37-17-19/h10,12,14,19-21,23-24,26-27,34,36H,9,11,13,15-17H2,1-8H3/t19-,20+,21-,23-,24+,26-,27+,30+,31-,32+/m1/s1
InChIKey DSJDMQKGNFHTBJ-KGFLTEPUSA-N
Mol Weight 528.7 g/mol
Molecular Formula C32H48O6
Exact Mass 528.345089 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1tZsZ343Upd
Name SAPELIN-E-ACETATE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H48O6
InChI InChI=1S/C32H48O6/c1-18(33)38-26-16-24-28(2,3)25(35)12-14-31(24,7)23-11-13-30(6)20(9-10-22(30)32(23,26)8)19-15-21(34)27(36)29(4,5)37-17-19/h10,12,14,19-21,23-24,26-27,34,36H,9,11,13,15-17H2,1-8H3/t19-,20+,21-,23-,24+,26-,27+,30+,31-,32+/m1/s1
InChIKey DSJDMQKGNFHTBJ-KGFLTEPUSA-N
Literature Reference Author K.MITSUI,H.SAITO,R.YAMAMURA,H.FUKAYA,Y.HITOTSUYANAGI,K.TAKEY A
Literature Reference Citation CHEM.PHARM.BULL.,55,1442(2007)
Literature Reference DOI 10.1248/cpb.55.1442
Molecular Weight 528.730 g/mol
Sample ID 33462
Solvent CDCl3