| Properties | Image |
|---|
| MNX_ID | MNXM180790 |
 |
| reference | slm:000030263 |
| formula | C59H98NO8P |
| global charge | 0 |
| mol weight | 980.406 |
| InChIKey | CCGCVNVKCBBXBT-RDAJYOHUSA-N |
| InChI | InChI=1S/C59H98NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-30-31-33-35-37-39-41-43-45-47-49-51-58(61)65-55-57(56-67-69(63,64)66-54-53-60)68-59(62)52-50-48-46-44-42-40-38-36-34-32-29-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,23-26,28,30,32-35,57H,3-5,7,9-10,15-16,21-22,27,29,31,36-56,60H2,1-2H3,(H,63,64)/b8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-28-,34-32-,35-33-/t57-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCC[NH3+] |
MNX internals
| InChI (mnx) | InChI=1/C59H98NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-30-31-33-35-37-39-41-43-45-47-49-51-58(61)65-55-57(56-67-69(63,64)66-54-53-60)68-59(62)52-50-48-46-44-42-40-38-36-34-32-29-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,23-26,28,30,32-35,57H,3-5,7,9-10,15-16,21-22,27,29,31,36-56,60H2,1-2H3,(H,63,64)/b8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-28-,34-32-,35-33-/t57-/m1/s1 |
 |
| 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]\[CH2:27]/[CH:28]=[CH:30]\[CH2:31]/[CH:33]=[CH:35]\[CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][C:58](=[O:61])[O:65][CH2:55][C@H:57]([CH2:56][O:67][P:69]([OH:63])(=[O:64])[O:66][CH2:54][CH2:53][NH2:60])[O:68][C:59]([CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36]/[CH:34]=[CH:32]\[CH2:29]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:62] |
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