Cer(t18:1(6OH)/16:0)

Properties Image MNX_ID MNXM1131424 reference lipidmapsM:LMSP02010148 formula C34H67NO4 global charge 0 mol weight 553.913 InChIKey CAXCJECPKVAJKC-GBIVXHQOSA-N InChI InChI=1S/C34H67NO4/c1-3-5-7-9-11-13-15-16-17-19-21-23-25-27-34(39)35-32(30-36)33(38)29-28-31(37)26-24-22-20-18-14-12-10-8-6-4-2/h28-29,31-33,36-38H,3-27,30H2,1-2H3,(H,35,39)/b29-28+/t31-,32+,33-/m1/s1 SMILES CCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)/C=C/[C@H](O)CCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C34H67NO4/c1-3-5-7-9-11-13-15-16-17-19-21-23-25-27-34(39)35-32(30-36)33(38)29-28-31(37)26-24-22-20-18-14-12-10-8-6-4-2/h28-29,31-33,36-38H,3-27,30H2,1-2H3,(H,35,39)/b29-28+/t31-,32+,33-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:16][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][C:34](=[N:35][C@@H:32]([CH2:30][OH:36])[C@@H:33](/[CH:29]=[CH:28]/[C@@H:31]([CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:37])[OH:38])[OH:39]

Parent-child relations graph

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