cupacinoside

Properties Image Occurences in reactions MNX_ID MNXM104126 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C40H62O14 charge 0 mass 766.41396 reference chebi:67815 InChIKey WIVIEKSHGBRJOH-UZZLBKCXSA-N InChI InChI=1S/C40H62O14/c1-23(2)14-11-15-24(3)16-12-17-25(4)18-13-19-26(5)20-21-47-39-36(34(46)33(45)32(53-39)22-48-28(7)41)54-40-38(52-31(10)44)37(51-30(9)43)35(27(6)49-40)50-29(8)42/h14,16,18,20,27,32-40,45-46H,11-13,15,17,19,21-22H2,1-10H3/b24-16+,25-18+,26-20+/t27-,32+,33+,34-,35-,36+,37+,38+,39+,40-/m0/s1 SMILES CC(=O)OC[C@H]1O[C@@H](OC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)[C@H](O[C@@H]2O[C@@H](C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph