compound 0164421

Properties Image Occurences in reactions MNX_ID MNXM1362626 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C54H89O13 charge -1 mass 945.63087 reference envipathM:...e3e421b54f14 InChIKey ITSJTIFHHOKZPU-UHFFFAOYSA-M InChI InChI=1S/C54H90O13/c1-3-5-7-9-10-13-20-29-42(55)30-21-18-19-27-38-53(61)64-43(41-63-52(60)37-26-17-12-15-24-33-47-54(67-47)44(56)31-22-8-6-4-2)40-62-51(59)36-25-16-11-14-23-32-45-48(65-45)39-49-46(66-49)34-28-35-50(57)58/h9-10,20,22,29,31,42-49,54-56H,3-8,11-19,21,23-28,30,32-41H2,1-2H3,(H,57,58)/p-1 SMILES CCCCC=CCC=CC(O)CCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1CCCC(=O)[O-])COC(=O)CCCCCCCC1OC1C(O)C=CCCCC

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Deprecated MNXref IDs graph