| Properties | Image |
|---|
| MNX_ID | MNXM112474 |
 |
| reference | lipidmapsM:LMGL03016029 |
| formula | C60H100O6 |
| global charge | 0 |
| mol weight | 917.454 |
| InChIKey | VTDIMOSMNLQCQT-QNECTCMHSA-N |
| InChI | InChI=1S/C60H100O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-33-35-38-41-44-47-50-53-59(62)65-56-57(55-64-58(61)52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)66-60(63)54-51-48-45-42-39-36-32-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-20,24-28,30-32,39,42,57H,4-7,9-10,12-15,18,21-23,29,33-38,40-41,43-56H2,1-3H3/b11-8-,19-16-,20-17-,27-24-,28-25-,31-30-,32-26-,42-39-/t57-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCC)COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C60H100O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-33-35-38-41-44-47-50-53-59(62)65-56-57(55-64-58(61)52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)66-60(63)54-51-48-45-42-39-36-32-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-20,24-28,30-32,39,42,57H,4-7,9-10,12-15,18,21-23,29,33-38,40-41,43-56H2,1-3H3/b11-8-,19-16-,20-17-,27-24-,28-25-,31-30-,32-26-,42-39-/t57-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][C:59](=[O:62])[O:65][CH2:56][C@@H:57]([CH2:55][O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34]/[CH:27]=[CH:24]\[CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:61])[O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45]/[CH:42]=[CH:39]\[CH2:36]/[CH:32]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:63] |
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