GT1b(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM28551 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C97H169N5O48 charge 0 mass 2172.0937 reference lipidmapsM:LMSP0601BW03 InChIKey LARCPNSOVUZAAZ-HBQJESBBSA-N InChI InChI=1S/C97H169N5O48/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-65(120)101-53(54(114)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2)49-137-89-77(128)76(127)80(63(46-108)140-89)142-91-79(130)87(150-97(94(135)136)40-57(117)69(102-66(121)48-110)85(148-97)75(126)62(45-107)145-95(92(131)132)38-55(115)67(98-50(3)111)83(146-95)71(122)58(118)41-103)81(64(47-109)141-91)143-88-70(100-52(5)113)82(73(124)60(43-105)138-88)144-90-78(129)86(74(125)61(44-106)139-90)149-96(93(133)134)39-56(116)68(99-51(4)112)84(147-96)72(123)59(119)42-104/h34,36,53-64,67-91,103-110,114-119,122-130H,6-33,35,37-49H2,1-5H3,(H,98,111)(H,99,112)(H,100,113)(H,101,120)(H,102,121)(H,131,132)(H,133,134)(H,135,136)/b36-34+/t53-,54+,55?,56?,57?,58+,59+,60?,61?,62+,63?,64?,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-,95+,96-,97-/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]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](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)C4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(=O)CO)C([C@H](O)[C@@H](CO)O[C@]4(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O4)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph