| Properties | Image |
|---|
| MNX_ID | MNXM337900 |
 |
| reference | slm:000180709 |
| formula | C58H102O6 |
| global charge | 0 |
| mol weight | 895.448 |
| InChIKey | FXQBVKQGKUXCEK-JXHWCJKVSA-N |
| InChI | InChI=1S/C58H102O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-37-40-43-46-49-52-58(61)64-55(53-62-56(59)50-47-44-41-38-35-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h15,17-18,20,25,27,31,33,39,42,55H,4-14,16,19,21-24,26,28-30,32,34-38,40-41,43-54H2,1-3H3/b18-15-,20-17-,27-25-,33-31-,42-39-/t55-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C58H102O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-37-40-43-46-49-52-58(61)64-55(53-62-56(59)50-47-44-41-38-35-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h15,17-18,20,25,27,31,33,39,42,55H,4-14,16,19,21-24,26,28-30,32,34-38,40-41,43-54H2,1-3H3/b18-15-,20-17-,27-25-,33-31-,42-39-/t55-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][C:58](=[O:61])[O:64][C@H:55]([CH2:53][O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:59])[CH2:54][O:63][C:57]([CH2:51][CH2:48][CH2:45]/[CH:42]=[CH:39]\[CH2:36]/[CH:33]=[CH:31]\[CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60] |
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