| Properties | Image |
|---|
| MNX_ID | MNXM228621 |
 |
| reference | slm:000198089 |
| formula | C60H102O6 |
| global charge | 0 |
| mol weight | 919.47 |
| InChIKey | GQMVVEYXLUDRPO-PSPBBZOJSA-N |
| InChI | InChI=1S/C60H102O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-31-35-39-43-47-51-58(61)64-54-57(55-65-59(62)52-48-44-40-36-33-29-30-34-38-42-46-50-56(3)4)66-60(63)53-49-45-41-37-32-28-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,13-16,19-22,26,28,37,41,56-57H,5-7,9,11-12,17-18,23-25,27,29-36,38-40,42-55H2,1-4H3/b10-8-,15-13-,16-14-,21-19-,22-20-,28-26-,41-37-/t57-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C60H102O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-31-35-39-43-47-51-58(61)64-54-57(55-65-59(62)52-48-44-40-36-33-29-30-34-38-42-46-50-56(3)4)66-60(63)53-49-45-41-37-32-28-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,13-16,19-22,26,28,37,41,56-57H,5-7,9,11-12,17-18,23-25,27,29-36,38-40,42-55H2,1-4H3/b10-8-,15-13-,16-14-,21-19-,22-20-,28-26-,41-37-/t57-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:23][CH2:25][CH2:27][CH2:31][CH2:35][CH2:39][CH2:43][CH2:47][CH2:51][C:58](=[O:61])[O:64][CH2:54][C@@H:57]([CH2:55][O:65][C:59]([CH2:52][CH2:48][CH2:44][CH2:40][CH2:36][CH2:33][CH2:29][CH2:30][CH2:34][CH2:38][CH2:42][CH2:46][CH2:50][CH:56]([CH3:3])[CH3:4])=[O:62])[O:66][C:60]([CH2:53][CH2:49][CH2:45]/[CH:41]=[CH:37]\[CH2:32]/[CH:28]=[CH:26]\[CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])=[O:63] |
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