| Properties | Image |
|---|
| MNX_ID | MNXM1131584 |
 |
| reference | lipidmapsM:LMSP02040065 |
| formula | C71H135NO5 |
| global charge | 0 |
| mol weight | 1082.863 |
| InChIKey | HTCIOAAVHOSRGL-CUZWDYSNSA-N |
| InChI | InChI=1S/C71H135NO5/c1-3-5-7-9-11-13-15-17-19-36-39-43-47-51-55-59-63-69(74)68(67-73)72-70(75)64-60-56-52-48-44-40-37-33-31-29-27-25-23-21-20-22-24-26-28-30-32-34-38-42-46-50-54-58-62-66-77-71(76)65-61-57-53-49-45-41-35-18-16-14-12-10-8-6-4-2/h12,14,18,35,59,63,68-69,73-74H,3-11,13,15-17,19-34,36-58,60-62,64-67H2,1-2H3,(H,72,75)/b14-12-,35-18-,63-59+/t68-,69+/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C71H135NO5/c1-3-5-7-9-11-13-15-17-19-36-39-43-47-51-55-59-63-69(74)68(67-73)72-70(75)64-60-56-52-48-44-40-37-33-31-29-27-25-23-21-20-22-24-26-28-30-32-34-38-42-46-50-54-58-62-66-77-71(76)65-61-57-53-49-45-41-35-18-16-14-12-10-8-6-4-2/h12,14,18,35,59,63,68-69,73-74H,3-11,13,15-17,19-34,36-58,60-62,64-67H2,1-2H3,(H,72,75)/b14-12-,35-18-,63-59+/t68-,69+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:36][CH2:39][CH2:43][CH2:47][CH2:51][CH2:55]/[CH:59]=[CH:63]/[C@H:69]([C@H:68]([CH2:67][OH:73])[N:72]=[C:70]([CH2:64][CH2:60][CH2:56][CH2:52][CH2:48][CH2:44][CH2:40][CH2:37][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:38][CH2:42][CH2:46][CH2:50][CH2:54][CH2:58][CH2:62][CH2:66][O:77][C:71]([CH2:65][CH2:61][CH2:57][CH2:53][CH2:49][CH2:45][CH2:41]/[CH:35]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:76])[OH:75])[OH:74] |
|