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1-butanoyl-2-(10Z,13Z,16Z,19Z,22Z,25Z-octacosahexaenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)

PropertiesImage
MNX_IDMNXM343352 Image of MNXM343352
referenceslm:000041395
formulaC38H62O10P
global charge-1
mol weight709.878
InChIKeyGQPUNAAOYCNMKT-QUJJKSNTSA-M
InChIInChI=1S/C38H63O10P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-38(42)48-36(33-45-37(41)29-4-2)34-47-49(43,44)46-32-35(40)31-39/h5-6,8-9,11-12,14-15,17-18,20-21,35-36,39-40H,3-4,7,10,13,16,19,22-34H2,1-2H3,(H,43,44)/p-1/b6-5-,9-8-,12-11-,15-14-,18-17-,21-20-/t35-,36+/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])OC[C@@H](O)CO
MNX internals
InChI (mnx)InChI=1/C38H63O10P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-38(42)48-36(33-45-37(41)29-4-2)34-47-49(43,44)46-32-35(40)31-39/h5-6,8-9,11-12,14-15,17-18,20-21,35-36,39-40H,3-4,7,10,13,16,19,22-34H2,1-2H3,(H,43,44)/b6-5-,9-8-,12-11-,15-14-,18-17-,21-20-/t35-,36+/m0/s1 Image of MNXM343352
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][C:38](=[O:42])[O:48][C@H:36]([CH2:33][O:45][C:37]([CH2:29][CH2:4][CH3:2])=[O:41])[CH2:34][O:47][P:49]([OH:43])(=[O:44])[O:46][CH2:32][C@H:35]([CH2:31][OH:39])[OH:40]
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:000041395
slm:000041395
GQPUNAAOYCNMKT-QUJJKSNTSA-M
1-butanoyl-2-(10Z,13Z,16Z,19Z,22Z,25Z-octacosahexaenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
PG(4:0/28:6(10Z,13Z,16Z,19Z,22Z,25Z))
Phosphatidylglycerol (4:0/28:6(10Z,13Z,16Z,19Z,22Z,25Z))