| Properties | Image |
|---|
| MNX_ID | MNXM1044285 |
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| reference | slm:000736674 |
| formula | C55H105NO8P |
| global charge | -1 |
| mol weight | 939.418 |
| InChIKey | IEFNUBNCFBKGHI-KWEPYYROSA-M |
| InChI | InChI=1S/C55H106NO8P/c1-4-7-10-13-16-18-20-22-24-25-26-27-28-30-32-34-36-39-42-45-49-61-51-53(52-63-65(59,60)62-50-48-56-54(57)46-43-40-37-15-12-9-6-3)64-55(58)47-44-41-38-35-33-31-29-23-21-19-17-14-11-8-5-2/h19,21-22,24,53H,4-18,20,23,25-52H2,1-3H3,(H,56,57)(H,59,60)/p-1/b21-19+,24-22-/t53-/m1/s1 |
| SMILES | CCCCCC/C=C/CCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H106NO8P/c1-4-7-10-13-16-18-20-22-24-25-26-27-28-30-32-34-36-39-42-45-49-61-51-53(52-63-65(59,60)62-50-48-56-54(57)46-43-40-37-15-12-9-6-3)64-55(58)47-44-41-38-35-33-31-29-23-21-19-17-14-11-8-5-2/h19,21-22,24,53H,4-18,20,23,25-52H2,1-3H3,(H,56,57)(H,59,60)/b21-19+,24-22-/t53-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:18][CH2:20]/[CH:22]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:39][CH2:42][CH2:45][CH2:49][O:61][CH2:51][C@H:53]([CH2:52][O:63][P:65]([OH:59])(=[O:60])[O:62][CH2:50][CH2:48][N:56]=[C:54]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:57])[O:64][C:55]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:33][CH2:31][CH2:29][CH2:23]/[CH:21]=[CH:19]/[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:58] |
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