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1-(10Z,13Z,16Z-docosatrienoyl)-2-tridecanoyl-3-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM185546 Image of MNXM185546
referenceslm:000217495
formulaC62H104O6
global charge0
mol weight945.508
InChIKeyPQHFQDQKNWXRQL-GBSYDZLYSA-N
InChIInChI=1S/C62H104O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-33-35-37-39-41-44-46-49-52-55-61(64)67-58-59(68-62(65)56-53-50-47-42-21-18-15-12-9-6-3)57-66-60(63)54-51-48-45-43-40-38-36-34-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,24-27,30-32,34-35,37,59H,4-6,8-9,11-15,18,21-23,28-29,33,36,38-58H2,1-3H3/b10-7-,19-16-,20-17-,26-24-,27-25-,31-30-,34-32-,37-35-/t59-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C62H104O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-33-35-37-39-41-44-46-49-52-55-61(64)67-58-59(68-62(65)56-53-50-47-42-21-18-15-12-9-6-3)57-66-60(63)54-51-48-45-43-40-38-36-34-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,24-27,30-32,34-35,37,59H,4-6,8-9,11-15,18,21-23,28-29,33,36,38-58H2,1-3H3/b10-7-,19-16-,20-17-,26-24-,27-25-,31-30-,34-32-,37-35-/t59-/m1/s1 Image of MNXM185546
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:30]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:39][CH2:41][CH2:44][CH2:46][CH2:49][CH2:52][CH2:55][C:61](=[O:64])[O:67][CH2:58][C@@H:59]([CH2:57][O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:43][CH2:40][CH2:38][CH2:36]/[CH:34]=[CH:32]\[CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:63])[O:68][C:62]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:42][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:65]
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:000217495
slm:000217495
PQHFQDQKNWXRQL-GBSYDZLYSA-N
1-(10Z,13Z,16Z-docosatrienoyl)-2-tridecanoyl-3-(9Z,12Z,15Z,18Z,21Z-tetracosapentaenoyl)-sn-glycerol
TG(22:3(10Z,13Z,16Z)/13:0/24:5(9Z,12Z,15Z,18Z,21Z))
Triacylglycerol (22:3(10Z,13Z,16Z)/13:0/24:5(9Z,12Z,15Z,18Z,21Z))