(10E)-19-(3-carboxylpropyl)vitamin D3 / (10E)-19-(3-carboxylpropyl)cholecalciferol

Properties Image Occurences in reactions MNX_ID MNXM30410 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C31H50O3 charge 0 mass 470.376 reference lipidmapsM:LMST03020493 InChIKey AVESXZIXJGDLRC-LVAGTQQESA-N InChI InChI=1S/C31H50O3/c1-22(2)9-7-10-23(3)28-18-19-29-25(12-8-20-31(28,29)4)14-15-26-21-27(32)17-16-24(26)11-5-6-13-30(33)34/h11,14-15,22-23,27-29,32H,5-10,12-13,16-21H2,1-4H3,(H,33,34)/b24-11+,25-14+,26-15-/t23-,27+,28-,29+,31-/m1/s1 SMILES CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2/C(=C/C=C3/C[C@@H](O)CC/C3=C\CCCC(=O)O)CCC[C@@]21C

Parent-child relations graph

Deprecated MNXref IDs graph