| Properties | Image |
|---|
| MNX_ID | MNXM307375 |
 |
| reference | slm:000160581 |
| formula | C56H94O6 |
| global charge | 0 |
| mol weight | 863.362 |
| InChIKey | KQMXZVRIYRRPGM-QCWZXMJASA-N |
| InChI | InChI=1S/C56H94O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-36-40-44-48-55(58)61-51-53(62-56(59)49-45-41-37-33-34-38-42-46-52(3)4)50-60-54(57)47-43-39-35-31-29-27-25-20-18-16-14-12-10-8-6-2/h13,15-16,18-21,23-25,28,30,36,40,52-53H,5-12,14,17,22,26-27,29,31-35,37-39,41-51H2,1-4H3/b15-13-,18-16+,21-19-,24-23-,25-20-,30-28-,40-36-/t53-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\C=C\CCCCCC)OC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C56H94O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-36-40-44-48-55(58)61-51-53(62-56(59)49-45-41-37-33-34-38-42-46-52(3)4)50-60-54(57)47-43-39-35-31-29-27-25-20-18-16-14-12-10-8-6-2/h13,15-16,18-21,23-25,28,30,36,40,52-53H,5-12,14,17,22,26-27,29,31-35,37-39,41-51H2,1-4H3/b15-13-,18-16+,21-19-,24-23-,25-20-,30-28-,40-36-/t53-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][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:40]\[CH2:44][CH2:48][C:55](=[O:58])[O:61][CH2:51][C@@H:53]([CH2:50][O:60][C:54]([CH2:47][CH2:43][CH2:39][CH2:35][CH2:31][CH2:29][CH2:27]/[CH:25]=[CH:20]\[CH:18]=[CH:16]\[CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:57])[O:62][C:56]([CH2:49][CH2:45][CH2:41][CH2:37][CH2:33][CH2:34][CH2:38][CH2:42][CH2:46][CH:52]([CH3:3])[CH3:4])=[O:59] |
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