| Properties | Image |
|---|
| MNX_ID | MNXM184639 |
 |
| reference | slm:000139897 |
| formula | C52H94O6 |
| global charge | 0 |
| mol weight | 815.318 |
| InChIKey | HWHXMVOWUPDNHV-XMECKOTRSA-N |
| InChI | InChI=1S/C52H94O6/c1-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-28-31-35-39-43-50(53)56-46-49(58-52(55)45-41-37-33-26-14-12-10-8-6-2)47-57-51(54)44-40-36-32-29-25-27-30-34-38-42-48(3)4/h13,15,17-18,20-21,48-49H,5-12,14,16,19,22-47H2,1-4H3/b15-13-,18-17-,21-20-/t49-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C52H94O6/c1-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-28-31-35-39-43-50(53)56-46-49(58-52(55)45-41-37-33-26-14-12-10-8-6-2)47-57-51(54)44-40-36-32-29-25-27-30-34-38-42-48(3)4/h13,15,17-18,20-21,48-49H,5-12,14,16,19,22-47H2,1-4H3/b15-13-,18-17-,21-20-/t49-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:28][CH2:31][CH2:35][CH2:39][CH2:43][C:50](=[O:53])[O:56][CH2:46][C@H:49]([CH2:47][O:57][C:51]([CH2:44][CH2:40][CH2:36][CH2:32][CH2:29][CH2:25][CH2:27][CH2:30][CH2:34][CH2:38][CH2:42][CH:48]([CH3:3])[CH3:4])=[O:54])[O:58][C:52]([CH2:45][CH2:41][CH2:37][CH2:33][CH2:26][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:55] |
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