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1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-2-hexadecanoyl-3-pentadecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM132826 Image of MNXM132826
referenceslm:000163936
formulaC56H100O6
global charge0
mol weight869.41
InChIKeyAHARKWTZAVEXCY-ULVWXFASSA-N
InChIInChI=1S/C56H100O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-32-34-37-40-43-46-49-55(58)61-52-53(51-60-54(57)48-45-42-39-36-33-24-21-18-15-12-9-6-3)62-56(59)50-47-44-41-38-35-31-23-20-17-14-11-8-5-2/h16,19,25-26,28-29,32,34,53H,4-15,17-18,20-24,27,30-31,33,35-52H2,1-3H3/b19-16-,26-25-,29-28-,34-32-/t53-/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C56H100O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-32-34-37-40-43-46-49-55(58)61-52-53(51-60-54(57)48-45-42-39-36-33-24-21-18-15-12-9-6-3)62-56(59)50-47-44-41-38-35-31-23-20-17-14-11-8-5-2/h16,19,25-26,28-29,32,34,53H,4-15,17-18,20-24,27,30-31,33,35-52H2,1-3H3/b19-16-,26-25-,29-28-,34-32-/t53-/m0/s1 Image of MNXM132826
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30]/[CH:32]=[CH:34]\[CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][C:55](=[O:58])[O:61][CH2:52][C@H:53]([CH2:51][O:60][C:54]([CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:57])[O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:31][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:59]
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:000163936
slm:000163936
AHARKWTZAVEXCY-ULVWXFASSA-N
1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-2-hexadecanoyl-3-pentadecanoyl-sn-glycerol
TG(22:4(7Z,10Z,13Z,16Z)/16:0/15:0)
Triacylglycerol (22:4(7Z,10Z,13Z,16Z)/16:0/15:0)
hmdb:HMDB0043038
AHARKWTZAVEXCY-ULVWXFASSA-N
TG(15:0/16:0/22:4(7Z,10Z,13Z,16Z))
(2S)-2-(hexadecanoyloxy)-3-(pentadecanoyloxy)propyl (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate
1-Pentadecanoyl-2-hexadecanoyl-3-(7Z,10Z,13Z,16Z-docosatetraenoyl)-glycerol
1-Pentadecanoyl-2-palmitoyl-3-adrenoyl-glycerol
TAG(15:0/16:0/22:4)
TAG(53:4)
TG(15:0/16:0/22:4)
TG(53:4)
Tracylglycerol(15:0/16:0/22:4)
Tracylglycerol(53:4)
Triacylglycerol
Triglyceride

hmdb:HMDB43038
secondary/obsolete/fantasy identifier