Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.

Compound

	ID:	1536
	Name:	(2R,3aR,5aS,5bS,9S,13R,14R,16aR,16bS)-13-{[(2R,5S,6S)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-4,14-dimethyl-9-propyl-2-{[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-1H,2H,3H,3aH,5aH,5bH,6H,7H,8H,9H,10H,11H,12H,13H,14H,15H,16aH,16bH-cyclododeca[b]as-indacene-7,15-dione
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: Spinosad Factor D
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	InChi Code:	InChI=1S/C41H65NO9/c1-8-10-25-11-9-12-35(51-36-14-13-34(42(6)7)23(4)48-36)22(3)37(44)33-20-32-29(30(33)17-26(43)16-25)15-21(2)28-18-27(19-31(28)32)50-41-40(47)39(46)38(45)24(5)49-41/h15,20,22-25,27-32,34-36,38-41,45-47H,8-14,16-19H2,1-7H3/t22-,23+,24+,25+,27+,28+,29+,30+,31-,32+,34+,35-,36+,38-,39-,40+,41+/m1/s1