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1-(11-methyldodecanoyl)-2-octacosanoyl-3-octadecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM188918 Image of MNXM188918
referenceslm:000231665
formulaC62H120O6
global charge0
mol weight961.636
InChIKeyMPLAUSPBTADXRG-MNPYLUJASA-N
InChIInChI=1S/C62H120O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-42-47-51-55-62(65)68-59(57-67-61(64)54-50-46-43-39-40-44-48-52-58(3)4)56-66-60(63)53-49-45-41-37-35-33-31-20-18-16-14-12-10-8-6-2/h58-59H,5-57H2,1-4H3/t59-/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C62H120O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-42-47-51-55-62(65)68-59(57-67-61(64)54-50-46-43-39-40-44-48-52-58(3)4)56-66-60(63)53-49-45-41-37-35-33-31-20-18-16-14-12-10-8-6-2/h58-59H,5-57H2,1-4H3/t59-/m0/s1 Image of MNXM188918
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:42][CH2:47][CH2:51][CH2:55][C:62](=[O:65])[O:68][C@@H:59]([CH2:56][O:66][C:60]([CH2:53][CH2:49][CH2:45][CH2:41][CH2:37][CH2:35][CH2:33][CH2:31][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:63])[CH2:57][O:67][C:61]([CH2:54][CH2:50][CH2:46][CH2:43][CH2:39][CH2:40][CH2:44][CH2:48][CH2:52][CH:58]([CH3:3])[CH3:4])=[O:64]
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:000231665
slm:000231665
MPLAUSPBTADXRG-MNPYLUJASA-N
1-(11-methyldodecanoyl)-2-octacosanoyl-3-octadecanoyl-sn-glycerol
TG(13:0/28:0/18:0)
Triacylglycerol (13:0/28:0/18:0)