| Properties | Image |
|---|
| MNX_ID | MNXM967227 |
 |
| reference | slm:000659612 |
| formula | C71H123NO9P |
| global charge | -1 |
| mol weight | 1165.737 |
| InChIKey | BFEHKNAWGVMZMY-PTEXLPIBSA-M |
| InChI | InChI=1S/C71H124NO9P/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-44-47-50-53-56-59-62-70(74)78-66-68(81-71(75)63-60-57-54-51-48-45-42-25-23-20-17-14-11-8-5-2)67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-49-46-21-18-15-12-9-6-3/h8,11,16-17,19-20,24-26,28-29,31-32,42,48,51,68H,4-7,9-10,12-15,18,21-23,27,30,33-41,43-47,49-50,52-67H2,1-3H3,(H,72,73)(H,76,77)/p-1/b11-8-,19-16-,20-17-,26-24-,29-28-,32-31-,42-25-,51-48-/t68-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C71H124NO9P/c1-4-7-10-13-16-19-22-24-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-43-44-47-50-53-56-59-62-70(74)78-66-68(81-71(75)63-60-57-54-51-48-45-42-25-23-20-17-14-11-8-5-2)67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-49-46-21-18-15-12-9-6-3/h8,11,16-17,19-20,24-26,28-29,31-32,42,48,51,68H,4-7,9-10,12-15,18,21-23,27,30,33-41,43-47,49-50,52-67H2,1-3H3,(H,72,73)(H,76,77)/b11-8-,19-16-,20-17-,26-24-,29-28-,32-31-,42-25-,51-48-/t68-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:43][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][C:70](=[O:74])[O:78][CH2:66][C@H:68]([CH2:67][O:80][P:82]([OH:76])(=[O:77])[O:79][CH2:65][CH2:64][N:72]=[C:69]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:73])[O:81][C:71]([CH2:63][CH2:60][CH2:57][CH2:54]/[CH:51]=[CH:48]\[CH2:45]/[CH:42]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:75] |
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