| Properties | Image |
|---|
| MNX_ID | MNXM193059 |
 |
| reference | slm:000140697 |
| formula | C52H96O6 |
| global charge | 0 |
| mol weight | 817.334 |
| InChIKey | ZBKWHRRAABOEMI-VCNZKAFHSA-N |
| InChI | InChI=1S/C52H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-33-35-38-41-44-50(53)56-47-49(58-52(55)46-43-40-37-32-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-34-31-29-27-25-23-20-17-14-11-8-5-2/h19-20,22-23,49H,4-18,21,24-48H2,1-3H3/b22-19-,23-20+/t49-/m0/s1 |
| SMILES | CCCCCC/C=C\CCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)OC(=O)CCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C52H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-33-35-38-41-44-50(53)56-47-49(58-52(55)46-43-40-37-32-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-34-31-29-27-25-23-20-17-14-11-8-5-2/h19-20,22-23,49H,4-18,21,24-48H2,1-3H3/b22-19-,23-20+/t49-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16]/[CH:19]=[CH:22]\[CH2:24][CH2:26][CH2:28][CH2:30][CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][C:50](=[O:53])[O:56][CH2:47][C@@H:49]([CH2:48][O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:34][CH2:31][CH2:29][CH2:27][CH2:25]/[CH:23]=[CH:20]/[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:54])[O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:32][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:55] |
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