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1,3-di-(9Z,12Z-octadecadienoyl)-2-(9Z-tetradecenoyl)-sn-glycerol
MNXM178616 is deprecated and replaced by MNXM136978
| Properties | Image |
MNX_ID | MNXM136978 |
 |
reference | slm:000143190 |
formula | C53H92O6 |
global charge | 0 |
mol weight | 825.313 |
InChIKey | VSNPWPPZQRMPJE-RWBIAYFFSA-N |
InChI | InChI=1S/C53H92O6/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-45-51(54)57-48-50(59-53(56)47-44-41-38-35-30-21-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h15-20,24-27,50H,4-14,21-23,28-49H2,1-3H3/b18-15-,19-16-,20-17-,26-24-,27-25- |
SMILES | CCCC/C=C\CCCCCCCC(=O)OC(COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCC/C=C\C/C=C\CCCCC |
MNX internals
InChI (mnx) | InChI=1/C53H92O6/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-45-51(54)57-48-50(59-53(56)47-44-41-38-35-30-21-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h15-20,24-27,50H,4-14,21-23,28-49H2,1-3H3/b18-15-,19-16-,20-17-,26-24-,27-25- |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28][CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][C:51](=[O:54])[O:57][CH2:48][CH:50]([CH2:49][O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:32][CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:55])[O:59][C:53]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:30][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:56] |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
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Similar chemical compounds in external resources
Identifier | Description |
SLM:000143190 slm:000143190 VSNPWPPZQRMPJE-RWBIAYFFSA-N
| 1,3-di-(9Z,12Z-octadecadienoyl)-2-(9Z-tetradecenoyl)-sn-glycerol TG(18:2(9Z,12Z)/14:1(9Z)/18:2(9Z,12Z)) Triacylglycerol (18:2(9Z,12Z)/14:1(9Z)/18:2(9Z,12Z))
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hmdb:HMDB0052501 VSNPWPPZQRMPJE-RWBIAYFFSA-N
| TG(18:2(9Z,12Z)/14:1(9Z)/18:2(9Z,12Z)) 1-(9Z,12Z-Octadecadienoyl)-2-(9Z-tetradecenoyl)-3-(9Z,12Z-octadecadienoyl)-glycerol 1-Linoleoyl-2-myristoleoyl-3-linoleoyl-glycerol 3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-2-[(9Z)-tetradec-9-enoyloxy]propyl (9Z,12Z)-octadeca-9,12-dienoate TAG(18:2/14:1/18:2) TAG(50:5) TG(18:2/14:1/18:2) TG(50:5) Tracylglycerol(18:2/14:1/18:2) Tracylglycerol(50:5) Triacylglycerol Triglyceride
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hmdb:HMDB52501
| secondary/obsolete/fantasy identifier
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