| Properties | Image |
|---|
| MNX_ID | MNXM315013 |
 |
| reference | slm:000180580 |
| formula | C58H102O6 |
| global charge | 0 |
| mol weight | 895.448 |
| InChIKey | VVFIJYHPPWDPGJ-AMFNEDMSSA-N |
| InChI | InChI=1S/C58H102O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-33-34-36-39-42-45-48-51-57(60)63-54-55(53-62-56(59)50-47-44-41-38-21-18-15-12-9-6-3)64-58(61)52-49-46-43-40-37-35-32-25-23-20-17-14-11-8-5-2/h16,19-20,23-24,26,28-29,31,33,55H,4-15,17-18,21-22,25,27,30,32,34-54H2,1-3H3/b19-16-,23-20+,26-24-,29-28-,33-31-/t55-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C/CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C58H102O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-33-34-36-39-42-45-48-51-57(60)63-54-55(53-62-56(59)50-47-44-41-38-21-18-15-12-9-6-3)64-58(61)52-49-46-43-40-37-35-32-25-23-20-17-14-11-8-5-2/h16,19-20,23-24,26,28-29,31,33,55H,4-15,17-18,21-22,25,27,30,32,34-54H2,1-3H3/b19-16-,23-20+,26-24-,29-28-,33-31-/t55-/m0/s1 |
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| 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]\[CH2:34][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][C:57](=[O:60])[O:63][CH2:54][C@H:55]([CH2:53][O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:59])[O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:35][CH2:32][CH2:25]/[CH:23]=[CH:20]/[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:61] |
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