| Properties | Image |
|---|
| MNX_ID | MNXM186821 |
 |
| reference | slm:000158273 |
| formula | C56H90O6 |
| global charge | 0 |
| mol weight | 859.33 |
| InChIKey | KYOWWTIQXJYDIZ-TZOZOCMJSA-N |
| InChI | InChI=1S/C56H90O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-36-41-45-49-56(59)62-53(51-61-55(58)48-44-40-37-33-34-38-42-46-52(3)4)50-60-54(57)47-43-39-35-31-29-27-25-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-21,23-25,28-31,36,41,52-53H,5-6,8,10-12,17-18,22,26-27,32-35,37-40,42-51H2,1-4H3/b9-7-,15-13-,16-14-,21-19-,24-23-,25-20-,30-28-,31-29-,41-36-/t53-/m0/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)CCCC/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C56H90O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-36-41-45-49-56(59)62-53(51-61-55(58)48-44-40-37-33-34-38-42-46-52(3)4)50-60-54(57)47-43-39-35-31-29-27-25-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-21,23-25,28-31,36,41,52-53H,5-6,8,10-12,17-18,22,26-27,32-35,37-40,42-51H2,1-4H3/b9-7-,15-13-,16-14-,21-19-,24-23-,25-20-,30-28-,31-29-,41-36-/t53-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:26]/[CH:28]=[CH:30]\[CH2:32]/[CH:36]=[CH:41]\[CH2:45][CH2:49][C:56](=[O:59])[O:62][C@@H:53]([CH2:50][O:60][C:54]([CH2:47][CH2:43][CH2:39][CH2:35]/[CH:31]=[CH:29]\[CH2:27]/[CH:25]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:57])[CH2:51][O:61][C:55]([CH2:48][CH2:44][CH2:40][CH2:37][CH2:33][CH2:34][CH2:38][CH2:42][CH2:46][CH:52]([CH3:3])[CH3:4])=[O:58] |
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