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1-(15Z,18Z,21Z,24Z,27Z-triacontapentaenoyl)-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)

PropertiesImage
MNX_IDMNXM232091 Image of MNXM232091
referenceslm:000038223
formulaC52H92O10P
global charge-1
mol weight908.272
InChIKeyQCROPMIURXLWNN-ZMQACHSZSA-M
InChIInChI=1S/C52H93O10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-51(55)59-47-50(48-61-63(57,58)60-46-49(54)45-53)62-52(56)44-42-40-38-36-34-31-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,23-24,49-50,53-54H,3-4,6,8-10,12,14-16,19,22,25-48H2,1-2H3,(H,57,58)/p-1/b7-5-,13-11-,18-17-,21-20-,24-23-/t49-,50+/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C52H93O10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-51(55)59-47-50(48-61-63(57,58)60-46-49(54)45-53)62-52(56)44-42-40-38-36-34-31-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,23-24,49-50,53-54H,3-4,6,8-10,12,14-16,19,22,25-48H2,1-2H3,(H,57,58)/b7-5-,13-11-,18-17-,21-20-,24-23-/t49-,50+/m0/s1 Image of MNXM232091
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][C:51](=[O:55])[O:59][CH2:47][C@H:50]([CH2:48][O:61][P:63]([OH:57])(=[O:58])[O:60][CH2:46][C@H:49]([CH2:45][OH:53])[OH:54])[O:62][C:52]([CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:31][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:56]
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

SLM:000038223
slm:000038223
QCROPMIURXLWNN-ZMQACHSZSA-M
1-(15Z,18Z,21Z,24Z,27Z-triacontapentaenoyl)-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)
PG(30:5(15Z,18Z,21Z,24Z,27Z)/16:0)
Phosphatidylglycerol (30:5(15Z,18Z,21Z,24Z,27Z)/16:0)