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1-acetyl-2-(16Z,19Z,22Z,25Z,28Z,31Z-tetratriacontahexaenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)

PropertiesImage
MNX_IDMNXM342445 Image of MNXM342445
referenceslm:000041339
formulaC42H70O10P
global charge-1
mol weight765.986
InChIKeyNMDBHNLZGBWAHV-SPCZRKAGSA-M
InChIInChI=1S/C42H71O10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-42(46)52-41(37-49-39(2)44)38-51-53(47,48)50-36-40(45)35-43/h4-5,7-8,10-11,13-14,16-17,19-20,40-41,43,45H,3,6,9,12,15,18,21-38H2,1-2H3,(H,47,48)/p-1/b5-4-,8-7-,11-10-,14-13-,17-16-,20-19-/t40-,41+/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OC[C@@H](O)CO
MNX internals
InChI (mnx)InChI=1/C42H71O10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-42(46)52-41(37-49-39(2)44)38-51-53(47,48)50-36-40(45)35-43/h4-5,7-8,10-11,13-14,16-17,19-20,40-41,43,45H,3,6,9,12,15,18,21-38H2,1-2H3,(H,47,48)/b5-4-,8-7-,11-10-,14-13-,17-16-,20-19-/t40-,41+/m0/s1 Image of MNXM342445
SMILES (mnx)[CH3:1][CH2:3]/[CH:4]=[CH:5]\[CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][C:42](=[O:46])[O:52][C@H:41]([CH2:37][O:49][C:39]([CH3:2])=[O:44])[CH2:38][O:51][P:53]([OH:47])(=[O:48])[O:50][CH2:36][C@H:40]([CH2:35][OH:43])[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:000041339
slm:000041339
NMDBHNLZGBWAHV-SPCZRKAGSA-M
1-acetyl-2-(16Z,19Z,22Z,25Z,28Z,31Z-tetratriacontahexaenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
PG(2:0/34:6(16Z,19Z,22Z,25Z,28Z,31Z))
Phosphatidylglycerol (2:0/34:6(16Z,19Z,22Z,25Z,28Z,31Z))