6-O-Methyl-N-deacetylisoipecoside aglycon

Properties Image Occurences in reactions MNX_ID MNXM114464 #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0 formula C20H25NO6 charge 0 mass 375.16819 reference keggC:C21583 InChIKey KOBLTMOWUOJKTH-ZWBYBESUSA-N InChI InChI=1S/C20H25NO6/c1-4-12-14(15(19(23)26-3)10-27-20(12)24)8-16-13-9-17(22)18(25-2)7-11(13)5-6-21-16/h4,7,9-10,12,14,16,20-22,24H,1,5-6,8H2,2-3H3/t12-,14+,16+,20-/m1/s1 SMILES C=C[C@@H]1[C@H](C[C@@H]2NCCc3cc(OC)c(O)cc32)C(C(=O)OC)=CO[C@H]1O

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Deprecated MNXref IDs graph