| Properties | Image |
|---|
| MNX_ID | MNXM1022098 |
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| reference | slm:000714487 |
| formula | C54H103NO8P |
| global charge | -1 |
| mol weight | 925.391 |
| InChIKey | IPNNHFVVQMLDBW-YSPKIESLSA-M |
| InChI | InChI=1S/C54H104NO8P/c1-4-7-10-13-16-19-22-24-25-26-27-28-30-32-35-38-41-44-48-60-50-52(63-54(57)46-43-40-37-34-21-18-15-12-9-6-3)51-62-64(58,59)61-49-47-55-53(56)45-42-39-36-33-31-29-23-20-17-14-11-8-5-2/h24-25,44,48,52H,4-23,26-43,45-47,49-51H2,1-3H3,(H,55,56)(H,58,59)/p-1/b25-24-,48-44-/t52-/m1/s1 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC/C=C\OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H104NO8P/c1-4-7-10-13-16-19-22-24-25-26-27-28-30-32-35-38-41-44-48-60-50-52(63-54(57)46-43-40-37-34-21-18-15-12-9-6-3)51-62-64(58,59)61-49-47-55-53(56)45-42-39-36-33-31-29-23-20-17-14-11-8-5-2/h24-25,44,48,52H,4-23,26-43,45-47,49-51H2,1-3H3,(H,55,56)(H,58,59)/b25-24-,48-44-/t52-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:24]=[CH:25]\[CH2:26][CH2:27][CH2:28][CH2:30][CH2:32][CH2:35][CH2:38][CH2:41]/[CH:44]=[CH:48]\[O:60][CH2:50][C@H:52]([CH2:51][O:62][P:64]([OH:58])(=[O:59])[O:61][CH2:49][CH2:47][N:55]=[C:53]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:31][CH2:29][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:56])[O:63][C:54]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:57] |
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