| Properties | Image |
|---|
| MNX_ID | MNXM235156 |
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| reference | slm:000294481 |
| formula | C73H120O6 |
| global charge | 0 |
| mol weight | 1093.757 |
| InChIKey | JLRCAYUHCMWSHB-VTDRJOOHSA-N |
| InChI | InChI=1S/C73H120O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-39-41-44-47-50-53-56-59-62-65-71(74)77-68-70(79-73(76)67-64-61-58-55-52-49-46-43-38-33-30-27-24-21-18-15-12-9-6-3)69-78-72(75)66-63-60-57-54-51-48-45-42-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h9,12,16,18-19,21,25-30,34,36,38,41,43-44,49-50,52-53,70H,4-8,10-11,13-15,17,20,22-24,31-33,35,37,39-40,42,45-48,51,54-69H2,1-3H3/b12-9-,19-16-,21-18-,28-25-,29-26-,30-27-,36-34-,43-38-,44-41-,52-49-,53-50-/t70-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C73H120O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-39-41-44-47-50-53-56-59-62-65-71(74)77-68-70(79-73(76)67-64-61-58-55-52-49-46-43-38-33-30-27-24-21-18-15-12-9-6-3)69-78-72(75)66-63-60-57-54-51-48-45-42-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h9,12,16,18-19,21,25-30,34,36,38,41,43-44,49-50,52-53,70H,4-8,10-11,13-15,17,20,22-24,31-33,35,37,39-40,42,45-48,51,54-69H2,1-3H3/b12-9-,19-16-,21-18-,28-25-,29-26-,30-27-,36-34-,43-38-,44-41-,52-49-,53-50-/t70-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:34]=[CH:36]\[CH2:39]/[CH:41]=[CH:44]\[CH2:47]/[CH:50]=[CH:53]\[CH2:56][CH2:59][CH2:62][CH2:65][C:71](=[O:74])[O:77][CH2:68][C@@H:70]([CH2:69][O:78][C:72]([CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:40][CH2:37][CH2:35][CH2:32]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:75])[O:79][C:73]([CH2:67][CH2:64][CH2:61][CH2:58][CH2:55]/[CH:52]=[CH:49]\[CH2:46]/[CH:43]=[CH:38]\[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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