| Properties | Image |
|---|
| MNX_ID | MNXM961098 |
 |
| reference | slm:000653483 |
| formula | C49H81NO9P |
| global charge | -1 |
| mol weight | 859.159 |
| InChIKey | FLRBEGCLPJJXLZ-SKTVQDJWSA-M |
| InChI | InChI=1S/C49H82NO9P/c1-4-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-41-49(53)56-44-47(59-46(3)51)45-58-60(54,55)57-43-42-50-48(52)40-38-36-34-32-30-28-26-19-17-15-13-11-9-7-5-2/h7,9,12-15,18-20,22-23,25-27,47H,4-6,8,10-11,16-17,21,24,28-45H2,1-3H3,(H,50,52)(H,54,55)/p-1/b9-7-,14-12-,15-13-,20-18-,23-22-,26-19-,27-25-/t47-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C49H82NO9P/c1-4-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-41-49(53)56-44-47(59-46(3)51)45-58-60(54,55)57-43-42-50-48(52)40-38-36-34-32-30-28-26-19-17-15-13-11-9-7-5-2/h7,9,12-15,18-20,22-23,25-27,47H,4-6,8,10-11,16-17,21,24,28-45H2,1-3H3,(H,50,52)(H,54,55)/b9-7-,14-12-,15-13-,20-18-,23-22-,26-19-,27-25-/t47-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:6][CH2:8][CH2:10]/[CH:12]=[CH:14]\[CH2:16]/[CH:18]=[CH:20]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:27]\[CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:49](=[O:53])[O:56][CH2:44][C@H:47]([CH2:45][O:58][P:60]([OH:54])(=[O:55])[O:57][CH2:43][CH2:42][N:50]=[C:48]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28]/[CH:26]=[CH:19]\[CH2:17]/[CH:15]=[CH:13]\[CH2:11]/[CH:9]=[CH:7]\[CH2:5][CH3:2])[OH:52])[O:59][C:46]([CH3:3])=[O:51] |
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