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TG(15:0/O-18:0/16:0)

PropertiesImage
MNX_IDMNXM133550 Image of MNXM133550
referencehmdb:HMDB0043802
formulaC52H102O5
global charge0
mol weight807.383
InChIKeyZMHGCGBYQJJQQE-DPDRHGIRSA-N
InChIInChI=1S/C52H102O5/c1-4-7-10-13-16-19-22-25-26-27-29-32-35-38-41-44-47-55-50(48-56-51(53)45-42-39-36-33-30-24-21-18-15-12-9-6-3)49-57-52(54)46-43-40-37-34-31-28-23-20-17-14-11-8-5-2/h50H,4-49H2,1-3H3/t50-/m0/s1
SMILESCCCCCCCCCCCCCCCCCCO[C@@H](COC(=O)CCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C52H102O5/c1-4-7-10-13-16-19-22-25-26-27-29-32-35-38-41-44-47-55-50(48-56-51(53)45-42-39-36-33-30-24-21-18-15-12-9-6-3)49-57-52(54)46-43-40-37-34-31-28-23-20-17-14-11-8-5-2/h50H,4-49H2,1-3H3/t50-/m0/s1 Image of MNXM133550
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:26][CH2:27][CH2:29][CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][O:55][C@@H:50]([CH2:48][O:56][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:53])[CH2:49][O:57][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:28][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:54]
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
hmdb:HMDB0043802
ZMHGCGBYQJJQQE-DPDRHGIRSA-N
TG(15:0/O-18:0/16:0)
(2S)-2-(Octadecyloxy)-3-(pentadecanoyloxy)propyl hexadecanoic acid
(2S)-2-(octadecyloxy)-3-(pentadecanoyloxy)propyl hexadecanoate
1-Pentadecanoyl-2-octadecanyl-3-hexadecanoyl-glycerol
1-Pentadecanoyl-2-stearyl-3-palmitoyl-glycerol
TAG(15:0/18:0/16:0)
TAG(49:0)
TG(15:0/18:0/16:0)
TG(15:0/o-18:0/16:0)
TG(49:0)
Tracylglycerol(15:0/18:0/16:0)
Tracylglycerol(49:0)
Triacylglycerol
Triglyceride

hmdb:HMDB43802
secondary/obsolete/fantasy identifier