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1-linoleoyl-2-(3E)-hexadecenoyl-phosphatidylglycerol

PropertiesImage
MNX_IDMNXM7979 Image of MNXM7979
referencemetacycM:CPD-2185
formulaC40H72O10P
global charge-1
mol weight743.98
InChIKeyQKKVMRCIRQQMDU-LUGIZMLVSA-M
InChIInChI=1S/C40H73O10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-39(43)47-35-38(36-49-51(45,46)48-34-37(42)33-41)50-40(44)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,28,30,37-38,41-42H,3-10,12,14-16,19-27,29,31-36H2,1-2H3,(H,45,46)/p-1/b13-11-,18-17-,30-28+/t37-,38+/m0/s1
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)C/C=C/CCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C40H73O10P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-39(43)47-35-38(36-49-51(45,46)48-34-37(42)33-41)50-40(44)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,28,30,37-38,41-42H,3-10,12,14-16,19-27,29,31-36H2,1-2H3,(H,45,46)/b13-11-,18-17-,30-28+/t37-,38+/m0/s1 Image of MNXM7979
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:20][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][C:39](=[O:43])[O:47][CH2:35][C@H:38]([CH2:36][O:49][P:51]([OH:45])(=[O:46])[O:48][CH2:34][C@H:37]([CH2:33][OH:41])[OH:42])[O:50][C:40]([CH2:32]/[CH:30]=[CH:28]/[CH2:26][CH2:24][CH2:22][CH2:19][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:44]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-2185
metacycM:CPD-2185
QKKVMRCIRQQMDU-LUGIZMLVSA-M
1-linoleoyl-2-(3E)-hexadecenoyl-phosphatidylglycerol
1-(9Z,12Z-octadecadienoyl)-2-(3E-hexadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
1-18:2-2-trans-16:1-phosphatidylglycerol
18:2-t16:1-PG

seed.compound:cpd24370
seedM:cpd24370
QKKVMRCIRQQMDU-LUGIZMLVSA-M
1-(9Z,12Z-octadecadienoyl)-2-(3E-hexadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
1-18:2-2-trans-16:1-phosphatidylglycerol
1-linoleoyl-2-(3E)-hexadecenoyl-phosphatidylglycerol
18:2-t16:1-PG

seedM:M_cpd24370
secondary/obsolete/fantasy identifier