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Monocrotaline	NEW: Predict NMR spectrum	RN:  315-22-0 MF:  C16H23NO6 MW:  325.36172 mp (°C):  197  - 204
InChI:  1S/C16H23NO6/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3 InChIKey:  QVCMHGGNRFRMAD-UHFFFAOYSA-N	H donor:  2 H acceptor:  7 Rotatable bond:  0 Stereocenter:  5	cLogP:  0.246 cLogS:  -1.003 Polar surface:  96.3
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