| Properties | Image |
|---|
| MNX_ID | MNXM210455 |
 |
| reference | slm:000031101 |
| formula | C53H88NO8P |
| global charge | 0 |
| mol weight | 898.26 |
| InChIKey | JHSHMBIYYXGSSJ-ZKWYNYEDSA-N |
| InChI | InChI=1S/C53H88NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-45-52(55)59-49-51(50-61-63(57,58)60-48-47-54)62-53(56)46-44-42-40-38-36-34-31-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,21-22,24-25,27-28,31,51H,3-4,9-10,15-16,20,23,26,29-30,32-50,54H2,1-2H3,(H,57,58)/b7-5-,8-6-,13-11-,14-12-,19-17-,22-21-,25-24-,28-27-,31-18-/t51-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC |
MNX internals
| InChI (mnx) | InChI=1/C53H88NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-33-35-37-39-41-43-45-52(55)59-49-51(50-61-63(57,58)60-48-47-54)62-53(56)46-44-42-40-38-36-34-31-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-19,21-22,24-25,27-28,31,51H,3-4,9-10,15-16,20,23,26,29-30,32-50,54H2,1-2H3,(H,57,58)/b7-5-,8-6-,13-11-,14-12-,19-17-,22-21-,25-24-,28-27-,31-18-/t51-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][CH2:30][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][C:52](=[O:55])[O:59][CH2:49][C@H:51]([CH2:50][O:61][P:63]([OH:57])(=[O:58])[O:60][CH2:48][CH2:47][NH2:54])[O:62][C:53]([CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34]/[CH:31]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:56] |
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