| Properties | Image |
|---|
| MNX_ID | MNXM336092 |
 |
| reference | slm:000177509 |
| formula | C58H98O6 |
| global charge | 0 |
| mol weight | 891.416 |
| InChIKey | NUFXOVBOZFBFAB-NITDABRGSA-N |
| InChI | InChI=1S/C58H98O6/c1-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-30-34-38-42-46-50-57(60)63-53-55(52-62-56(59)49-45-41-37-33-28-16-14-12-10-8-6-2)64-58(61)51-47-43-39-35-31-27-29-32-36-40-44-48-54(3)4/h7,9,12-15,18-19,21-22,24-25,30,34,54-55H,5-6,8,10-11,16-17,20,23,26-29,31-33,35-53H2,1-4H3/b9-7-,14-12-,15-13-,19-18-,22-21-,25-24-,34-30-/t55-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\CCCC)OC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C58H98O6/c1-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-30-34-38-42-46-50-57(60)63-53-55(52-62-56(59)49-45-41-37-33-28-16-14-12-10-8-6-2)64-58(61)51-47-43-39-35-31-27-29-32-36-40-44-48-54(3)4/h7,9,12-15,18-19,21-22,24-25,30,34,54-55H,5-6,8,10-11,16-17,20,23,26-29,31-33,35-53H2,1-4H3/b9-7-,14-12-,15-13-,19-18-,22-21-,25-24-,34-30-/t55-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:30]=[CH:34]\[CH2:38][CH2:42][CH2:46][CH2:50][C:57](=[O:60])[O:63][CH2:53][C@@H:55]([CH2:52][O:62][C:56]([CH2:49][CH2:45][CH2:41][CH2:37][CH2:33][CH2:28][CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH3:2])=[O:59])[O:64][C:58]([CH2:51][CH2:47][CH2:43][CH2:39][CH2:35][CH2:31][CH2:27][CH2:29][CH2:32][CH2:36][CH2:40][CH2:44][CH2:48][CH:54]([CH3:3])[CH3:4])=[O:61] |
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