| Properties | Image |
|---|
| MNX_ID | MNXM110711 |
 |
| reference | lipidmapsM:LMGL03014472 |
| formula | C56H96O6 |
| global charge | 0 |
| mol weight | 865.378 |
| InChIKey | VOXMKNTXXNUTDM-XDEICUGNSA-N |
| InChI | InChI=1S/C56H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-34-37-40-43-46-49-55(58)61-52-53(51-60-54(57)48-45-42-39-36-33-21-18-15-12-9-6-3)62-56(59)50-47-44-41-38-35-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24,26-27,29-31,37,40,53H,4-6,8-9,11-15,17-18,20-23,25,28,32-36,38-39,41-52H2,1-3H3/b10-7-,19-16-,26-24-,29-27-,31-30-,40-37-/t53-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C56H96O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-34-37-40-43-46-49-55(58)61-52-53(51-60-54(57)48-45-42-39-36-33-21-18-15-12-9-6-3)62-56(59)50-47-44-41-38-35-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24,26-27,29-31,37,40,53H,4-6,8-9,11-15,17-18,20-23,25,28,32-36,38-39,41-52H2,1-3H3/b10-7-,19-16-,26-24-,29-27-,31-30-,40-37-/t53-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:30]=[CH:31]\[CH2:34]/[CH:37]=[CH:40]\[CH2:43][CH2:46][CH2:49][C:55](=[O:58])[O:61][CH2:52][C@@H:53]([CH2:51][O:60][C:54]([CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:57])[O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32]/[CH:29]=[CH:27]\[CH2:25][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:59] |
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