| Properties | Image |
|---|
| MNX_ID | MNXM180405 |
 |
| reference | slm:000007817 |
| formula | C54H94NO8P |
| global charge | 0 |
| mol weight | 916.319 |
| InChIKey | QGSMOLDGIOUMFG-RUJMEAEFSA-N |
| InChI | InChI=1S/C54H94NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-33-34-36-38-40-42-44-46-53(56)60-50-52(51-62-64(58,59)61-49-48-55(3,4)5)63-54(57)47-45-43-41-39-37-35-32-21-19-17-15-13-11-9-7-2/h8,10,14,16,20-22,24-25,27-28,30-32,52H,6-7,9,11-13,15,17-19,23,26,29,33-51H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,28-27-,31-30-,32-21-/t52-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-33-34-36-38-40-42-44-46-53(56)60-50-52(51-62-64(58,59)61-49-48-55(3,4)5)63-54(57)47-45-43-41-39-37-35-32-21-19-17-15-13-11-9-7-2/h8,10,14,16,20-22,24-25,27-28,30-32,52H,6-7,9,11-13,15,17-19,23,26,29,33-51H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,28-27-,31-30-,32-21-/t52-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:33][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:53](=[O:56])[O:60][CH2:50][C@H:52]([CH2:51][O:62][P:64](=[O:58])([O-:59])[O:61][CH2:49][CH2:48][N+:55]([CH3:3])([CH3:4])[CH3:5])[O:63][C:54]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35]/[CH:32]=[CH:21]\[CH2:19][CH2:17][CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:57] |
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