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1-(9Z,12Z-octadecadienoyl)-2-(9Z-tetradecenoyl)-3-tetradecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM131170 Image of MNXM131170
referenceslm:000130790
formulaC49H88O6
global charge0
mol weight773.237
InChIKeyGYTJPFXYRURXOG-UOQAICIDSA-N
InChIInChI=1S/C49H88O6/c1-4-7-10-13-16-19-22-23-24-25-28-30-33-36-39-42-48(51)54-45-46(55-49(52)43-40-37-34-31-27-21-18-15-12-9-6-3)44-53-47(50)41-38-35-32-29-26-20-17-14-11-8-5-2/h15-16,18-19,23-24,46H,4-14,17,20-22,25-45H2,1-3H3/b18-15-,19-16-,24-23-/t46-/m0/s1
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C49H88O6/c1-4-7-10-13-16-19-22-23-24-25-28-30-33-36-39-42-48(51)54-45-46(55-49(52)43-40-37-34-31-27-21-18-15-12-9-6-3)44-53-47(50)41-38-35-32-29-26-20-17-14-11-8-5-2/h15-16,18-19,23-24,46H,4-14,17,20-22,25-45H2,1-3H3/b18-15-,19-16-,24-23-/t46-/m0/s1 Image of MNXM131170
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25][CH2:28][CH2:30][CH2:33][CH2:36][CH2:39][CH2:42][C:48](=[O:51])[O:54][CH2:45][C@H:46]([CH2:44][O:53][C:47]([CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:26][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:50])[O:55][C:49]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:27][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:52]
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:000130790
slm:000130790
GYTJPFXYRURXOG-UOQAICIDSA-N
1-(9Z,12Z-octadecadienoyl)-2-(9Z-tetradecenoyl)-3-tetradecanoyl-sn-glycerol
TG(18:2(9Z,12Z)/14:1(9Z)/14:0)
Triacylglycerol (18:2(9Z,12Z)/14:1(9Z)/14:0)
hmdb:HMDB0042286
GYTJPFXYRURXOG-UOQAICIDSA-N
TG(14:0/14:1(9Z)/18:2(9Z,12Z))
(2S)-2-[(9Z)-tetradec-9-enoyloxy]-3-(tetradecanoyloxy)propyl (9Z,12Z)-octadeca-9,12-dienoate
1-Myristoyl-2-myristoleoyl-3-linoleoyl-glycerol
1-Tetradecanoyl-2-(9Z-tetradecenoyl)-3-(9Z,12Z-octadecadienoyl)-glycerol
TAG(14:0/14:1/18:2)
TAG(46:3)
TG(14:0/14:1/18:2)
TG(46:3)
Tracylglycerol(14:0/14:1/18:2)
Tracylglycerol(46:3)
Triacylglycerol
Triglyceride

hmdb:HMDB42286
secondary/obsolete/fantasy identifier