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1-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-2-dodecanoyl-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM194100 Image of MNXM194100
referenceslm:000021234
formulaC41H69O8P
global charge-2
mol weight720.969
InChIKeyJDNKDYVPDDIGGG-XYMLHFHCSA-L
InChIInChI=1S/C41H71O8P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28-29-31-33-35-40(42)47-37-39(38-48-50(44,45)46)49-41(43)36-34-32-30-27-12-10-8-6-4-2/h5,7,11,13,15-16,18-19,21-22,39H,3-4,6,8-10,12,14,17,20,23-38H2,1-2H3,(H2,44,45,46)/p-2/b7-5-,13-11-,16-15-,19-18-,22-21-/t39-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C41H71O8P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28-29-31-33-35-40(42)47-37-39(38-48-50(44,45)46)49-41(43)36-34-32-30-27-12-10-8-6-4-2/h5,7,11,13,15-16,18-19,21-22,39H,3-4,6,8-10,12,14,17,20,23-38H2,1-2H3,(H2,44,45,46)/b7-5-,13-11-,16-15-,19-18-,22-21-/t39-/m1/s1 Image of MNXM194100
SMILES (mnx)[CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23][CH2:24][CH2:25][CH2:26][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][C:40](=[O:42])[O:47][CH2:37][C@H:39]([CH2:38][O:48][P:50]([OH:44])([OH:45])=[O:46])[O:49][C:41]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:27][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:43]
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:000021234
slm:000021234
JDNKDYVPDDIGGG-XYMLHFHCSA-L
1-(11Z,14Z,17Z,20Z,23Z-hexacosapentaenoyl)-2-dodecanoyl-sn-glycero-3-phosphate
PA(26:5(11Z,14Z,17Z,20Z,23Z)/12:0)
Phosphatidate (26:5(11Z,14Z,17Z,20Z,23Z)/12:0)