| Properties | Image |
| MNX_ID | MNXM32114 |
 |
| reference | lipidmapsM:LMGL03050001 |
| formula | C57H88O8 |
| global charge | 0 |
| mol weight | 901.323 |
| InChIKey | MURVBZHSZNEGRB-PCWWDKSPSA-N |
| InChI | InChI=1S/C57H88O8/c1-4-7-10-13-16-18-20-22-24-26-28-30-33-37-42-47-55(59)63-51-53(65-57(61)49-44-38-34-31-29-27-25-23-21-19-17-14-11-8-5-2)52-64-56(60)48-43-39-35-40-45-50-62-54(58)46-41-36-32-15-12-9-6-3/h7-8,10-11,16-19,22-25,32,35-36,41,45-46,53H,4-6,9,12-15,20-21,26-31,33-34,37-39,42-44,47-52H2,1-3H3/b10-7-,11-8-,18-16-,19-17-,24-22-,25-23-,36-32-,46-41+/t40?,53-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCC=C=CCOC(=O)/C=C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC |
MNX internals
| InChI (mnx) | InChI=1/C57H88O8/c1-4-7-10-13-16-18-20-22-24-26-28-30-33-37-42-47-55(59)63-51-53(65-57(61)49-44-38-34-31-29-27-25-23-21-19-17-14-11-8-5-2)52-64-56(60)48-43-39-35-40-45-50-62-54(58)46-41-36-32-15-12-9-6-3/h7-8,10-11,16-19,22-25,32,35-36,41,45-46,53H,4-6,9,12-15,20-21,26-31,33-34,37-39,42-44,47-52H2,1-3H3/b10-7-,11-8-,18-16-,19-17-,24-22-,25-23-,36-32-,46-41+/t40?,53-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26][CH2:28][CH2:30][CH2:33][CH2:37][CH2:42][CH2:47][C:55](=[O:59])[O:63][CH2:51][C@H:53]([CH2:52][O:64][C:56]([CH2:48][CH2:43][CH2:39][CH:35]=[C:40]=[CH:45][CH2:50][O:62][C:54](/[CH:46]=[CH:41]/[CH:36]=[CH:32]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:58])=[O:60])[O:65][C:57]([CH2:49][CH2:44][CH2:38][CH2:34][CH2:31][CH2:29][CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:61] |
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