Cer(d18:2(4E,8E)/14:0(2OH))

Properties Image MNX_ID MNXM1131487 reference lipidmapsM:LMSP02010216 formula C32H61NO4 global charge 0 mol weight 523.843 InChIKey OXGAGPAURVYCEQ-RTXLMFJXSA-N InChI InChI=1S/C32H61NO4/c1-3-5-7-9-11-13-15-16-17-19-20-22-24-26-30(35)29(28-34)33-32(37)31(36)27-25-23-21-18-14-12-10-8-6-4-2/h17,19,24,26,29-31,34-36H,3-16,18,20-23,25,27-28H2,1-2H3,(H,33,37)/b19-17+,26-24+/t29-,30+,31+/m0/s1 SMILES CCCCCCCCC/C=C/CC/C=C/[C@@H](O)[C@H](CO)NC(=O)[C@H](O)CCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C32H61NO4/c1-3-5-7-9-11-13-15-16-17-19-20-22-24-26-30(35)29(28-34)33-32(37)31(36)27-25-23-21-18-14-12-10-8-6-4-2/h17,19,24,26,29-31,34-36H,3-16,18,20-23,25,27-28H2,1-2H3,(H,33,37)/b19-17+,26-24+/t29-,30+,31+/m0/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:16]/[CH:17]=[CH:19]/[CH2:20][CH2:22]/[CH:24]=[CH:26]/[C@H:30]([C@H:29]([CH2:28][OH:34])[N:33]=[C:32]([C@@H:31]([CH2:27][CH2:25][CH2:23][CH2:21][CH2:18][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:36])[OH:37])[OH:35]

Parent-child relations graph

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