| Properties | Image |
|---|
| MNX_ID | MNXM315799 |
 |
| reference | slm:000004937 |
| formula | C62H105NO10P |
| global charge | -1 |
| mol weight | 1055.493 |
| InChIKey | ITLXKRFBXPRSQZ-VLZVKYJASA-M |
| InChI | InChI=1S/C62H106NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-48-50-52-54-61(65)73-58(56-71-74(68,69)72-57-59(63)62(66)67)55-70-60(64)53-51-49-47-45-43-41-39-37-35-33-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-25,27-28,33,37,39,58-59H,3-10,15-16,21-22,26,29-32,34-36,38,40-57,63H2,1-2H3,(H,66,67)(H,68,69)/p-1/b13-11-,14-12-,19-17-,20-18-,25-23-,28-27-,33-24-,39-37-/t58-,59+/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C62H106NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-48-50-52-54-61(65)73-58(56-71-74(68,69)72-57-59(63)62(66)67)55-70-60(64)53-51-49-47-45-43-41-39-37-35-33-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-25,27-28,33,37,39,58-59H,3-10,15-16,21-22,26,29-32,34-36,38,40-57,63H2,1-2H3,(H,66,67)(H,68,69)/b13-11-,14-12-,19-17-,20-18-,25-23-,28-27-,33-24-,39-37-/t58-,59+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][CH2:30][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][C:61](=[O:65])[O:73][C@H:58]([CH2:55][O:70][C:60]([CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43][CH2:41]/[CH:39]=[CH:37]\[CH2:35]/[CH:33]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:64])[CH2:56][O:71][P:74]([OH:68])(=[O:69])[O:72][CH2:57][C@@H:59]([C:62](=[O:66])[OH:67])[NH2:63] |
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