| Properties | Image |
|---|
| MNX_ID | MNXM966092 |
 |
| reference | slm:000658477 |
| formula | C71H121NO9P |
| global charge | -1 |
| mol weight | 1163.721 |
| InChIKey | JEGBHYKBMNNXDQ-AZUPLMJLSA-M |
| InChI | InChI=1S/C71H122NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-30-31-32-33-34-35-36-37-38-40-41-43-45-47-50-53-56-59-62-70(74)78-66-68(67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-49-18-15-12-9-6-3)81-71(75)63-60-57-54-51-48-46-44-42-39-28-26-24-22-20-17-14-11-8-5-2/h8,11,16-17,19-20,23-26,29-30,32-33,39,42,46,48,68H,4-7,9-10,12-15,18,21-22,27-28,31,34-38,40-41,43-45,47,49-67H2,1-3H3,(H,72,73)(H,76,77)/p-1/b11-8-,19-16-,20-17-,25-23-,26-24-,30-29-,33-32-,42-39-,48-46-/t68-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C71H122NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-30-31-32-33-34-35-36-37-38-40-41-43-45-47-50-53-56-59-62-70(74)78-66-68(67-80-82(76,77)79-65-64-72-69(73)61-58-55-52-49-18-15-12-9-6-3)81-71(75)63-60-57-54-51-48-46-44-42-39-28-26-24-22-20-17-14-11-8-5-2/h8,11,16-17,19-20,23-26,29-30,32-33,39,42,46,48,68H,4-7,9-10,12-15,18,21-22,27-28,31,34-38,40-41,43-45,47,49-67H2,1-3H3,(H,72,73)(H,76,77)/b11-8-,19-16-,20-17-,25-23-,26-24-,30-29-,33-32-,42-39-,48-46-/t68-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:30]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:41][CH2:43][CH2:45][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][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:73])[O:81][C:71]([CH2:63][CH2:60][CH2:57][CH2:54][CH2:51]/[CH:48]=[CH:46]\[CH2:44]/[CH:42]=[CH:39]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:75] |
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