Ins-1-P-6-Man-1-6-Ins-1-P-Cer C 46:0(2-)

Properties Image MNX_ID MNXM156806 reference chebi:75027 formula C24H41NO26P2*2 global charge -2 mol weight   InChIKey   InChI   SMILES [*]C(O)C(=O)N[C@@H](COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1OC1O[C@H](COP(=O)([O-])O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O)[C@@H]([*])O MNX internals InChI (mnx) InChI=1/C26H49NO26P2/c1-5(28)9(30)7(27-25(43)6(2)29)3-48-54(44,45)53-24-20(41)16(37)15(36)19(40)23(24)51-26-21(42)11(32)10(31)8(50-26)4-49-55(46,47)52-22-17(38)13(34)12(33)14(35)18(22)39/h5-24,26,28-42H,3-4H2,1-2H3,(H,27,43)(H,44,45)(H,46,47)/t5-,6?,7+,8-,9-,10-,11+,12-,13-,14+,15-,16-,17-,18-,19+,20-,21+,22-,23-,24-,26?/m1/s1/i1+1,2+1 SMILES (mnx) [13CH3:1][C@H:5]([C@H:9]([C@H:7]([CH2:3][O:48][P:54]([OH:44])(=[O:45])[O:53][C@@H:24]1[C@H:20]([OH:41])[C@H:16]([OH:37])[C@@H:15]([OH:36])[C@H:19]([OH:40])[C@H:23]1[O:51][CH:26]1[C@@H:21]([OH:42])[C@@H:11]([OH:32])[C@H:10]([OH:31])[C@@H:8]([CH2:4][O:49][P:55]([OH:46])(=[O:47])[O:52][C@@H:22]2[C@H:17]([OH:38])[C@H:13]([OH:34])[C@@H:12]([OH:33])[C@H:14]([OH:35])[C@H:18]2[OH:39])[O:50]1)[N:27]=[C:25]([CH:6]([13CH3:2])[OH:29])[OH:43])[OH:30])[OH:28]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0