sLea-x(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM27112 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C101H178N4O49 charge 0 mass 2231.15597 reference lipidmapsM:LMSP0601EN03 InChIKey PHNLDVMJHYGHSH-RTBDWWNVSA-N InChI InChI=1S/C101H178N4O49/c1-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-64(119)105-54(55(116)38-36-34-32-30-28-26-21-19-17-15-13-11-9-2)48-137-94-79(131)76(128)83(61(45-110)145-94)146-97-80(132)89(71(123)58(42-107)140-97)151-92-66(103-52(6)114)87(149-96-78(130)75(127)69(121)50(4)139-96)85(63(47-112)144-92)148-98-81(133)90(72(124)59(43-108)141-98)152-93-67(104-53(7)115)88(84(62(46-111)143-93)147-95-77(129)74(126)68(120)49(3)138-95)150-99-82(134)91(73(125)60(44-109)142-99)154-101(100(135)136)40-56(117)65(102-51(5)113)86(153-101)70(122)57(118)41-106/h36,38,49-50,54-63,65-99,106-112,116-118,120-134H,8-35,37,39-48H2,1-7H3,(H,102,113)(H,103,114)(H,104,115)(H,105,119)(H,135,136)/b38-36+/t49?,50?,54-,55+,56?,57+,58?,59?,60?,61?,62?,63?,65+,66?,67?,68+,69+,70+,71-,72-,73-,74?,75?,76+,77-,78-,79?,80?,81?,82?,83+,84+,85+,86?,87+,88+,89-,90-,91-,92-,93-,94+,95+,96+,97-,98-,99-,101-/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[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]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@]7(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O7)C6O)C5NC(C)=O)C4O)[C@H](O[C@H]4OC(C)[C@@H](O)C(O)[C@@H]4O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph