| Properties | Image |
|---|
| MNX_ID | MNXM109943 |
 |
| reference | lipidmapsM:LMGL03013777 |
| formula | C51H86O6 |
| global charge | 0 |
| mol weight | 795.243 |
| InChIKey | HORMYYXMVKQDLO-ULJCNFGFSA-N |
| InChI | InChI=1S/C51H86O6/c1-4-7-10-13-16-19-22-24-25-26-27-28-30-32-35-38-41-44-50(53)56-47-48(46-55-49(52)43-40-37-34-31-21-18-15-12-9-6-3)57-51(54)45-42-39-36-33-29-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,24-25,27-28,32,35,48H,4-6,8-9,11-15,18,21-23,26,29-31,33-34,36-47H2,1-3H3/b10-7-,19-16-,20-17-,25-24-,28-27-,35-32-/t48-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C51H86O6/c1-4-7-10-13-16-19-22-24-25-26-27-28-30-32-35-38-41-44-50(53)56-47-48(46-55-49(52)43-40-37-34-31-21-18-15-12-9-6-3)57-51(54)45-42-39-36-33-29-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,24-25,27-28,32,35,48H,4-6,8-9,11-15,18,21-23,26,29-31,33-34,36-47H2,1-3H3/b10-7-,19-16-,20-17-,25-24-,28-27-,35-32-/t48-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:30]/[CH:32]=[CH:35]\[CH2:38][CH2:41][CH2:44][C:50](=[O:53])[O:56][CH2:47][C@@H:48]([CH2:46][O:55][C:49]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:52])[O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:29][CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:54] |
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