| Properties | Image |
|---|
| MNX_ID | MNXM190799 |
 |
| reference | slm:000143602 |
| formula | C53H92O6 |
| global charge | 0 |
| mol weight | 825.313 |
| InChIKey | BMCFJQJMQXBLBE-UBDWTHJFSA-N |
| InChI | InChI=1S/C53H92O6/c1-4-7-10-13-16-19-21-23-25-26-28-30-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-31-29-27-24-22-20-17-14-11-8-5-2/h16,19-20,22-23,25,28,30,35,38,50H,4-15,17-18,21,24,26-27,29,31-34,36-37,39-49H2,1-3H3/b19-16-,22-20+,25-23-,30-28-,38-35-/t50-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)COC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H92O6/c1-4-7-10-13-16-19-21-23-25-26-28-30-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-31-29-27-24-22-20-17-14-11-8-5-2/h16,19-20,22-23,25,28,30,35,38,50H,4-15,17-18,21,24,26-27,29,31-34,36-37,39-49H2,1-3H3/b19-16-,22-20+,25-23-,30-28-,38-35-/t50-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:26]/[CH:28]=[CH:30]\[CH2:32]/[CH:35]=[CH:38]\[CH2:41][CH2:44][CH2:47][C:53](=[O:56])[O:59][C@@H:50]([CH2:48][O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:54])[CH2:49][O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:29][CH2:27][CH2:24]/[CH:22]=[CH:20]/[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:55] |
|