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Cer(d14:2(4E,6E)/18:1(9Z))

PropertiesImage
MNX_IDMNXM153302 Image of MNXM153302
referencechebi:168984
formulaC32H59NO3
global charge0
mol weight505.828
InChIKeyCGTRJQCZAJENJT-LPDDRZGOSA-N
InChIInChI=1S/C32H59NO3/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-28-32(36)33-30(29-34)31(35)27-25-23-21-19-12-10-8-6-4-2/h15-16,21,23,25,27,30-31,34-35H,3-14,17-20,22,24,26,28-29H2,1-2H3,(H,33,36)/b16-15-,23-21+,27-25+/t30-,31+/m0/s1
SMILESCCCCCCC/C=C/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C32H59NO3/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-28-32(36)33-30(29-34)31(35)27-25-23-21-19-12-10-8-6-4-2/h15-16,21,23,25,27,30-31,34-35H,3-14,17-20,22,24,26,28-29H2,1-2H3,(H,33,36)/b16-15-,23-21+,27-25+/t30-,31+/m0/s1 Image of MNXM153302
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:14]/[CH:15]=[CH:16]\[CH2:17][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][C:32](=[N:33][C@@H:30]([CH2:29][OH:34])[C@@H:31](/[CH:27]=[CH:25]/[CH:23]=[CH:21]/[CH2:19][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:35])[OH:36]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:168984
chebi:168984
CGTRJQCZAJENJT-LPDDRZGOSA-N
Cer(d14:2(4E,6E)/18:1(9Z))
(Z)-N-[(2S,3R,4E,6E)-1,3-dihydroxytetradeca-4,6-dien-2-yl]octadec-9-enamide

lipidmaps:LMSP02010053
lipidmapsM:LMSP02010053
CGTRJQCZAJENJT-LPDDRZGOSA-N
Cer(d14:2(4E,6E)/18:1(9Z))
Cer 32:3
Cer[NS]
N-(9Z-octadecenoyl)-4E,6E-tetradecasphingadienine
O2