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21-DESETHYL-21-(N-PROPYL)-SPINOSYN_A
SpectraBase Compound ID JkG3rJRw90E
InChI InChI=1S/C42H67NO10/c1-10-12-27-13-11-14-35(53-37-18-17-34(43(5)6)24(3)49-37)23(2)38(45)33-21-31-29(32(33)22-36(44)51-27)16-15-26-19-28(20-30(26)31)52-42-41(48-9)40(47-8)39(46-7)25(4)50-42/h15-16,21,23-32,34-35,37,39-42H,10-14,17-20,22H2,1-9H3/t23-,24+,25+,26+,27-,28+,29+,30+,31+,32-,34-,35-,37-,39+,40-,41-,42+/m0/s1
InChIKey NANVBXWBBQSZMI-MTZFLAINSA-N
Mol Weight 746.0 g/mol
Molecular Formula C42H67NO10
Exact Mass 745.476497 g/mol
Enantiomer InChIKey NANVBXWBBQSZMI-MTOLSYCMSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Engineering of the Spinosyn PKS:  Directing Starter Unit Incorporation Journal of Natural Products 2006

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