| Properties | Image |
|---|
| MNX_ID | MNXM957286 |
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| reference | slm:000649671 |
| formula | C55H99NO9P |
| global charge | -1 |
| mol weight | 949.369 |
| InChIKey | MLMVOJSIHHTHKC-NYPYJJNSSA-M |
| InChI | InChI=1S/C55H100NO9P/c1-4-7-10-13-16-19-21-23-25-26-28-29-31-34-37-40-43-46-54(58)62-50-52(65-55(59)47-44-41-38-35-32-30-27-24-22-20-17-14-11-8-5-2)51-64-66(60,61)63-49-48-56-53(57)45-42-39-36-33-18-15-12-9-6-3/h16,19,23-25,27-29,52H,4-15,17-18,20-22,26,30-51H2,1-3H3,(H,56,57)(H,60,61)/p-1/b19-16-,25-23-,27-24-,29-28-/t52-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H100NO9P/c1-4-7-10-13-16-19-21-23-25-26-28-29-31-34-37-40-43-46-54(58)62-50-52(65-55(59)47-44-41-38-35-32-30-27-24-22-20-17-14-11-8-5-2)51-64-66(60,61)63-49-48-56-53(57)45-42-39-36-33-18-15-12-9-6-3/h16,19,23-25,27-29,52H,4-15,17-18,20-22,26,30-51H2,1-3H3,(H,56,57)(H,60,61)/b19-16-,25-23-,27-24-,29-28-/t52-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:26]/[CH:28]=[CH:29]\[CH2:31][CH2:34][CH2:37][CH2:40][CH2:43][CH2:46][C:54](=[O:58])[O:62][CH2:50][C@H:52]([CH2:51][O:64][P:66]([OH:60])(=[O:61])[O:63][CH2:49][CH2:48][N:56]=[C:53]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:57])[O:65][C:55]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:30]/[CH:27]=[CH:24]\[CH2:22][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:59] |
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