KDN-lactotetraosylceramide(d18:1/24:1(15Z))

Properties Image Occurences in reactions MNX_ID MNXM27602 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C77H138N2O31 charge 0 mass 1586.92836 reference lipidmapsM:LMSP0601EB07 InChIKey HQXNWZRTQHVHRV-YOMWHDFCSA-N InChI InChI=1S/C77H138N2O31/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-39-56(89)79-48(49(86)38-36-34-32-30-28-26-17-15-13-11-9-7-5-2)46-101-73-64(96)63(95)67(55(45-84)105-73)106-74-65(97)69(61(93)53(43-82)103-74)108-72-57(78-47(3)85)68(60(92)52(42-81)102-72)107-75-66(98)71(62(94)54(44-83)104-75)110-77(76(99)100)40-50(87)58(90)70(109-77)59(91)51(88)41-80/h18-19,36,38,48-55,57-75,80-84,86-88,90-98H,4-17,20-35,37,39-46H2,1-3H3,(H,78,85)(H,79,89)(H,99,100)/b19-18-,38-36+/t48-,49+,50?,51+,52?,53?,54?,55?,57?,58+,59+,60+,61-,62-,63+,64?,65?,66?,67+,68+,69-,70?,71-,72-,73+,74-,75-,77-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O)[C@H](O[C@@H]3OC(CO)[C@@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@]5(C(=O)O)CC(O)[C@@H](O)C([C@H](O)[C@H](O)CO)O5)C4O)C3NC(C)=O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph