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1-(13-methyltetradecanoyl)-2-(13Z-docosenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)

PropertiesImage
MNX_IDMNXM212712 Image of MNXM212712
referenceslm:000037619
formulaC43H82O10P
global charge-1
mol weight790.093
InChIKeyCCTQZDSWBADDOE-UWSJFRPISA-M
InChIInChI=1S/C43H83O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-28-31-34-43(47)53-41(38-52-54(48,49)51-36-40(45)35-44)37-50-42(46)33-30-27-24-22-19-20-23-26-29-32-39(2)3/h11-12,39-41,44-45H,4-10,13-38H2,1-3H3,(H,48,49)/p-1/b12-11-/t40-,41+/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC(C)C)COP(=O)([O-])OC[C@@H](O)CO
MNX internals
InChI (mnx)InChI=1/C43H83O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-28-31-34-43(47)53-41(38-52-54(48,49)51-36-40(45)35-44)37-50-42(46)33-30-27-24-22-19-20-23-26-29-32-39(2)3/h11-12,39-41,44-45H,4-10,13-38H2,1-3H3,(H,48,49)/b12-11-/t40-,41+/m0/s1 Image of MNXM212712
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]/[CH:11]=[CH:12]\[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:21][CH2:25][CH2:28][CH2:31][CH2:34][C:43](=[O:47])[O:53][C@H:41]([CH2:37][O:50][C:42]([CH2:33][CH2:30][CH2:27][CH2:24][CH2:22][CH2:19][CH2:20][CH2:23][CH2:26][CH2:29][CH2:32][CH:39]([CH3:2])[CH3:3])=[O:46])[CH2:38][O:52][P:54]([OH:48])(=[O:49])[O:51][CH2:36][C@H:40]([CH2:35][OH:44])[OH:45]
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:000037619
slm:000037619
CCTQZDSWBADDOE-UWSJFRPISA-M
1-(13-methyltetradecanoyl)-2-(13Z-docosenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
PG(15:0/22:1(13Z))
Phosphatidylglycerol (15:0/22:1(13Z))