| Properties | Image |
|---|
| MNX_ID | MNXM1047842 |
 |
| reference | slm:000740231 |
| formula | C47H79NO8P |
| global charge | -1 |
| mol weight | 817.122 |
| InChIKey | DWSHPWSCKWSVLD-ILWNYAITSA-M |
| InChI | InChI=1S/C47H80NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-39-46(50)48-41-42-55-57(52,53)56-44-45(49)43-54-47(51)40-38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,22,24,27,29,33,35,45,49H,3-4,6,8-10,12,14-16,21,23,25-26,28,30-32,34,36-44H2,1-2H3,(H,48,50)(H,52,53)/p-1/b7-5-,13-11-,19-17-,20-18-,24-22-,29-27-,35-33-/t45-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@H](O)COC(=O)CCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C47H80NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-37-39-46(50)48-41-42-55-57(52,53)56-44-45(49)43-54-47(51)40-38-36-34-32-30-28-26-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,22,24,27,29,33,35,45,49H,3-4,6,8-10,12,14-16,21,23,25-26,28,30-32,34,36-44H2,1-2H3,(H,48,50)(H,52,53)/b7-5-,13-11-,19-17-,20-18-,24-22-,29-27-,35-33-/t45-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:22]=[CH:24]\[CH2:25]/[CH:27]=[CH:29]\[CH2:31]/[CH:33]=[CH:35]\[CH2:37][CH2:39][C:46](=[N:48][CH2:41][CH2:42][O:55][P:57]([OH:52])(=[O:53])[O:56][CH2:44][C@@H:45]([CH2:43][O:54][C:47]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:23]/[CH:20]=[CH:18]\[CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:51])[OH:49])[OH:50] |
|