| Properties | Image |
|---|
| MNX_ID | MNXM213176 |
 |
| reference | slm:000177996 |
| formula | C58H98O6 |
| global charge | 0 |
| mol weight | 891.416 |
| InChIKey | UNUZDKUBUYRGGZ-VSUXPRRFSA-N |
| InChI | InChI=1S/C58H98O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-34-39-43-47-51-58(61)64-55(53-63-57(60)50-46-42-38-35-31-32-36-40-44-48-54(3)4)52-62-56(59)49-45-41-37-33-29-27-25-20-18-16-14-12-10-8-6-2/h7,9,13,15,19,21,23-24,28-30,33,39,43,54-55H,5-6,8,10-12,14,16-18,20,22,25-27,31-32,34-38,40-42,44-53H2,1-4H3/b9-7-,15-13-,21-19-,24-23-,30-28-,33-29-,43-39-/t55-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@@H](COC(=O)CCCC/C=C\CCCCCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C58H98O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-34-39-43-47-51-58(61)64-55(53-63-57(60)50-46-42-38-35-31-32-36-40-44-48-54(3)4)52-62-56(59)49-45-41-37-33-29-27-25-20-18-16-14-12-10-8-6-2/h7,9,13,15,19,21,23-24,28-30,33,39,43,54-55H,5-6,8,10-12,14,16-18,20,22,25-27,31-32,34-38,40-42,44-53H2,1-4H3/b9-7-,15-13-,21-19-,24-23-,30-28-,33-29-,43-39-/t55-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH: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]\[CH2:34]/[CH:39]=[CH:43]\[CH2:47][CH2:51][C:58](=[O:61])[O:64][C@@H:55]([CH2:52][O:62][C:56]([CH2:49][CH2:45][CH2:41][CH2:37]/[CH:33]=[CH:29]\[CH2:27][CH2:25][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:59])[CH2:53][O:63][C:57]([CH2:50][CH2:46][CH2:42][CH2:38][CH2:35][CH2:31][CH2:32][CH2:36][CH2:40][CH2:44][CH2:48][CH:54]([CH3:3])[CH3:4])=[O:60] |
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