| Properties | Image |
|---|
| MNX_ID | MNXM959979 |
 |
| reference | slm:000652364 |
| formula | C57H91NO9P |
| global charge | -1 |
| mol weight | 965.327 |
| InChIKey | ZPXHXCFUSLWHLV-ZIPDAOIBSA-M |
| InChI | InChI=1S/C57H92NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-33-35-37-39-42-44-47-55(59)58-50-51-65-68(62,63)66-53-54(67-57(61)49-46-41-12-9-6-3)52-64-56(60)48-45-43-40-38-36-34-32-30-28-26-24-22-20-18-16-14-11-8-5-2/h7,10,15-18,21-24,27-30,33-36,39,42,54H,4-6,8-9,11-14,19-20,25-26,31-32,37-38,40-41,43-53H2,1-3H3,(H,58,59)(H,62,63)/p-1/b10-7-,17-15-,18-16-,23-21-,24-22-,29-27-,30-28-,35-33-,36-34-,42-39-/t54-/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](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C57H92NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-33-35-37-39-42-44-47-55(59)58-50-51-65-68(62,63)66-53-54(67-57(61)49-46-41-12-9-6-3)52-64-56(60)48-45-43-40-38-36-34-32-30-28-26-24-22-20-18-16-14-11-8-5-2/h7,10,15-18,21-24,27-30,33-36,39,42,54H,4-6,8-9,11-14,19-20,25-26,31-32,37-38,40-41,43-53H2,1-3H3,(H,58,59)(H,62,63)/b10-7-,17-15-,18-16-,23-21-,24-22-,29-27-,30-28-,35-33-,36-34-,42-39-/t54-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25]/[CH:27]=[CH:29]\[CH2:31]/[CH:33]=[CH:35]\[CH2:37]/[CH:39]=[CH:42]\[CH2:44][CH2:47][C:55](=[N:58][CH2:50][CH2:51][O:65][P:68]([OH:62])(=[O:63])[O:66][CH2:53][C@@H:54]([CH2:52][O:64][C:56]([CH2:48][CH2:45][CH2:43][CH2:40][CH2:38]/[CH:36]=[CH:34]\[CH2:32]/[CH:30]=[CH:28]\[CH2:26]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[O:67][C:57]([CH2:49][CH2:46][CH2:41][CH2:12][CH2:9][CH2:6][CH3:3])=[O:61])[OH:59] |
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