klymollin C

Properties Image Occurences in reactions MNX_ID MNXM105971 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C26H38O9 charge 0 mass 494.25158 reference chebi:68953 InChIKey IJXBJCLCYUSOPN-YRLDIHFHSA-N InChI InChI=1S/C26H38O9/c1-12(2)19-20-21(26(11-31-26)24(33-15(5)28)22(19)32-14(4)27)18-10-13(3)17(30)8-9-25(7,23(20)34-18)35-16(6)29/h12,17-24,30H,3,8-11H2,1-2,4-7H3/t17-,18+,19+,20+,21+,22-,23+,24-,25+,26+/m0/s1 SMILES C=C1C[C@H]2O[C@H]([C@H]3[C@@H]2[C@]2(CO2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3C(C)C)[C@](C)(OC(C)=O)CC[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph