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1-(9Z-hexadecenoyl)-2-(17Z-hexacosenoyl)-3-(13-methyltetradecanoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM329712 Image of MNXM329712
referenceslm:000206492
formulaC60H112O6
global charge0
mol weight929.55
InChIKeySYDJXGHXRUIXRL-NQGLEHALSA-N
InChIInChI=1S/C60H112O6/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-36-41-45-49-53-60(63)66-57(55-65-59(62)52-48-44-40-37-33-34-38-42-46-50-56(3)4)54-64-58(61)51-47-43-39-35-31-29-18-16-14-12-10-8-6-2/h16,18-20,56-57H,5-15,17,21-55H2,1-4H3/b18-16-,20-19-/t57-/m1/s1
SMILESCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C60H112O6/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-36-41-45-49-53-60(63)66-57(55-65-59(62)52-48-44-40-37-33-34-38-42-46-50-56(3)4)54-64-58(61)51-47-43-39-35-31-29-18-16-14-12-10-8-6-2/h16,18-20,56-57H,5-15,17,21-55H2,1-4H3/b18-16-,20-19-/t57-/m1/s1 Image of MNXM329712
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17]/[CH:19]=[CH:20]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:32][CH2:36][CH2:41][CH2:45][CH2:49][CH2:53][C:60](=[O:63])[O:66][C@H:57]([CH2:54][O:64][C:58]([CH2:51][CH2:47][CH2:43][CH2:39][CH2:35][CH2:31][CH2:29]/[CH:18]=[CH:16]\[CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:61])[CH2:55][O:65][C:59]([CH2:52][CH2:48][CH2:44][CH2:40][CH2:37][CH2:33][CH2:34][CH2:38][CH2:42][CH2:46][CH2:50][CH:56]([CH3:3])[CH3:4])=[O:62]
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:000206492
slm:000206492
SYDJXGHXRUIXRL-NQGLEHALSA-N
1-(9Z-hexadecenoyl)-2-(17Z-hexacosenoyl)-3-(13-methyltetradecanoyl)-sn-glycerol
TG(16:1(9Z)/26:1(17Z)/15:0)
Triacylglycerol (16:1(9Z)/26:1(17Z)/15:0)