| Properties | Image |
|---|
| MNX_ID | MNXM219166 |
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| reference | slm:000295181 |
| formula | C73H124O6 |
| global charge | 0 |
| mol weight | 1097.789 |
| InChIKey | KXMPKXLQBGVLTK-WPRRJXRFSA-N |
| InChI | InChI=1S/C73H124O6/c1-4-7-10-13-16-19-22-25-28-31-34-35-36-37-40-42-45-48-51-54-57-60-63-66-72(75)78-69-70(79-73(76)67-64-61-58-55-52-49-46-43-39-33-30-27-24-21-18-15-12-9-6-3)68-77-71(74)65-62-59-56-53-50-47-44-41-38-32-29-26-23-20-17-14-11-8-5-2/h9,12,17-18,20-21,25-30,39,43,49,52,58,61,70H,4-8,10-11,13-16,19,22-24,31-38,40-42,44-48,50-51,53-57,59-60,62-69H2,1-3H3/b12-9-,20-17-,21-18-,28-25-,29-26-,30-27-,43-39-,52-49-,61-58-/t70-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C73H124O6/c1-4-7-10-13-16-19-22-25-28-31-34-35-36-37-40-42-45-48-51-54-57-60-63-66-72(75)78-69-70(79-73(76)67-64-61-58-55-52-49-46-43-39-33-30-27-24-21-18-15-12-9-6-3)68-77-71(74)65-62-59-56-53-50-47-44-41-38-32-29-26-23-20-17-14-11-8-5-2/h9,12,17-18,20-21,25-30,39,43,49,52,58,61,70H,4-8,10-11,13-16,19,22-24,31-38,40-42,44-48,50-51,53-57,59-60,62-69H2,1-3H3/b12-9-,20-17-,21-18-,28-25-,29-26-,30-27-,43-39-,52-49-,61-58-/t70-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:31][CH2:34][CH2:35][CH2:36][CH2:37][CH2:40][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][C:72](=[O:75])[O:78][CH2:69][C@@H:70]([CH2:68][O:77][C:71]([CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:74])[O:79][C:73]([CH2:67][CH2:64]/[CH:61]=[CH:58]\[CH2:55]/[CH:52]=[CH:49]\[CH2:46]/[CH:43]=[CH:39]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:76] |
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