| Properties | Image |
|---|
| MNX_ID | MNXM276436 |
 |
| reference | slm:000187821 |
| formula | C59H100O6 |
| global charge | 0 |
| mol weight | 905.443 |
| InChIKey | AOFFFKWMVQOVLY-CRSVPRMESA-N |
| InChI | InChI=1S/C59H100O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-33-35-38-40-43-46-49-52-58(61)64-55-56(65-59(62)53-50-47-44-41-36-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-37-34-32-25-23-20-17-14-11-8-5-2/h15-16,18-19,24-26,28-29,31-33,38,40,56H,4-14,17,20-23,27,30,34-37,39,41-55H2,1-3H3/b18-15-,19-16-,26-24-,29-28-,32-25-,33-31-,40-38-/t56-/m0/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C59H100O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-33-35-38-40-43-46-49-52-58(61)64-55-56(65-59(62)53-50-47-44-41-36-21-18-15-12-9-6-3)54-63-57(60)51-48-45-42-39-37-34-32-25-23-20-17-14-11-8-5-2/h15-16,18-19,24-26,28-29,31-33,38,40,56H,4-14,17,20-23,27,30,34-37,39,41-55H2,1-3H3/b18-15-,19-16-,26-24-,29-28-,32-25-,33-31-,40-38-/t56-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:33]\[CH2:35]/[CH:38]=[CH:40]\[CH2:43][CH2:46][CH2:49][CH2:52][C:58](=[O:61])[O:64][CH2:55][C@H:56]([CH2:54][O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:37][CH2:34]/[CH:32]=[CH:25]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:36][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:62] |
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