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1-(13-methyltetradecanoyl)-2-heneicosanoyl-3-octacosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM214934 Image of MNXM214934
referenceslm:000273331
formulaC67H130O6
global charge0
mol weight1031.771
InChIKeyNIKUTWAOQWWXQV-JVUALNACSA-N
InChIInChI=1S/C67H130O6/c1-5-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-33-34-36-38-42-46-50-54-58-65(68)71-61-64(62-72-66(69)59-55-51-47-44-40-41-45-49-53-57-63(3)4)73-67(70)60-56-52-48-43-39-37-35-32-24-22-20-18-16-14-12-10-8-6-2/h63-64H,5-62H2,1-4H3/t64-/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C67H130O6/c1-5-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-33-34-36-38-42-46-50-54-58-65(68)71-61-64(62-72-66(69)59-55-51-47-44-40-41-45-49-53-57-63(3)4)73-67(70)60-56-52-48-43-39-37-35-32-24-22-20-18-16-14-12-10-8-6-2/h63-64H,5-62H2,1-4H3/t64-/m0/s1 Image of MNXM214934
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:33][CH2:34][CH2:36][CH2:38][CH2:42][CH2:46][CH2:50][CH2:54][CH2:58][C:65](=[O:68])[O:71][CH2:61][C@@H:64]([CH2:62][O:72][C:66]([CH2:59][CH2:55][CH2:51][CH2:47][CH2:44][CH2:40][CH2:41][CH2:45][CH2:49][CH2:53][CH2:57][CH:63]([CH3:3])[CH3:4])=[O:69])[O:73][C:67]([CH2:60][CH2:56][CH2:52][CH2:48][CH2:43][CH2:39][CH2:37][CH2:35][CH2:32][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:70]
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:000273331
slm:000273331
NIKUTWAOQWWXQV-JVUALNACSA-N
1-(13-methyltetradecanoyl)-2-heneicosanoyl-3-octacosanoyl-sn-glycerol
TG(15:0/21:0/28:0)
Triacylglycerol (15:0/21:0/28:0)