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1,3-diheptadecanoyl-2-tridecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM178909 Image of MNXM178909
referenceslm:000134785
formulaC50H96O6
global charge0
mol weight793.312
InChIKeyBJAMKIABXOTXFI-UHFFFAOYSA-N
InChIInChI=1S/C50H96O6/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-48(51)54-45-47(56-50(53)44-41-38-35-30-21-18-15-12-9-6-3)46-55-49(52)43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h47H,4-46H2,1-3H3
SMILESCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C50H96O6/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-48(51)54-45-47(56-50(53)44-41-38-35-30-21-18-15-12-9-6-3)46-55-49(52)43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h47H,4-46H2,1-3H3 Image of MNXM178909
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:24][CH2:26][CH2:28][CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][C:48](=[O:51])[O:54][CH2:45][CH:47]([CH2:46][O:55][C:49]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:32][CH2:29][CH2:27][CH2:25][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:52])[O:56][C:50]([CH2:44][CH2:41][CH2:38][CH2:35][CH2:30][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:53]
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:000134785
slm:000134785
BJAMKIABXOTXFI-UHFFFAOYSA-N
1,3-diheptadecanoyl-2-tridecanoyl-sn-glycerol
TG(17:0/13:0/17:0)
Triacylglycerol (17:0/13:0/17:0)