22:1 Stigmasterol ester

Properties Image Occurences in reactions MNX_ID MNXM150705 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C51H88O2 charge 0 mass 732.67843 reference lipidmapsM:LMST01020082 InChIKey NLIOVVITKRXSOR-BWRJRZOPSA-N InChI InChI=1S/C51H88O2/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-49(52)53-44-35-37-50(6)43(39-44)31-32-45-47-34-33-46(51(47,7)38-36-48(45)50)41(5)29-30-42(9-2)40(3)4/h16-17,29-31,40-42,44-48H,8-15,18-28,32-39H2,1-7H3/b17-16-,30-29+/t41-,42-,44+,45+,46-,47+,48+,50+,51-/m1/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@@H]2[C@H](C)/C=C/[C@@H](CC)C(C)C)C1

Parent-child relations graph

Deprecated MNXref IDs graph