| Properties | Image |
|---|
| MNX_ID | MNXM1022677 |
 |
| reference | slm:000715066 |
| formula | C69H115NO8P |
| global charge | -1 |
| mol weight | 1117.652 |
| InChIKey | PYMMUJFBWKBYJV-XJHVBBNTSA-M |
| InChI | InChI=1S/C69H116NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-37-40-43-46-49-52-55-58-61-69(72)78-67(65-75-63-59-56-53-50-47-44-41-38-36-33-31-29-26-23-20-17-14-11-8-5-2)66-77-79(73,74)76-64-62-70-68(71)60-57-54-51-48-45-42-39-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25-29,32,34,37,39-40,45-46,48-49,59,63,67H,4-6,8-9,11-15,17,20,22-24,30-31,33,35-36,38,41-44,47,50-58,60-62,64-66H2,1-3H3,(H,70,71)(H,73,74)/p-1/b10-7-,19-16-,21-18-,28-25-,29-26-,34-32-,39-27-,40-37-,48-45-,49-46-,63-59-/t67-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H116NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-37-40-43-46-49-52-55-58-61-69(72)78-67(65-75-63-59-56-53-50-47-44-41-38-36-33-31-29-26-23-20-17-14-11-8-5-2)66-77-79(73,74)76-64-62-70-68(71)60-57-54-51-48-45-42-39-27-24-21-18-15-12-9-6-3/h7,10,16,18-19,21,25-29,32,34,37,39-40,45-46,48-49,59,63,67H,4-6,8-9,11-15,17,20,22-24,30-31,33,35-36,38,41-44,47,50-58,60-62,64-66H2,1-3H3,(H,70,71)(H,73,74)/b10-7-,19-16-,21-18-,28-25-,29-26-,34-32-,39-27-,40-37-,48-45-,49-46-,63-59-/t67-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:35]/[CH:37]=[CH:40]\[CH2:43]/[CH:46]=[CH:49]\[CH2:52][CH2:55][CH2:58][CH2:61][C:69](=[O:72])[O:78][C@H:67]([CH2:65][O:75]/[CH:63]=[CH:59]\[CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:36][CH2:33][CH2:31]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[CH2:66][O:77][P:79]([OH:73])(=[O:74])[O:76][CH2:64][CH2:62][N:70]=[C:68]([CH2:60][CH2:57][CH2:54][CH2:51]/[CH:48]=[CH:45]\[CH2:42]/[CH:39]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:71] |
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