| Properties | Image |
|---|
| MNX_ID | MNXM963650 |
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| reference | slm:000656035 |
| formula | C81H143NO9P |
| global charge | -1 |
| mol weight | 1306.007 |
| InChIKey | IOEYDQGMKQZTLO-GWMJBLGKSA-M |
| InChI | InChI=1S/C81H144NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-39-41-43-45-48-51-54-57-60-63-66-69-72-80(84)88-76-78(77-90-92(86,87)89-75-74-82-79(83)71-68-65-62-59-56-53-50-47-30-27-24-21-18-15-12-9-6-3)91-81(85)73-70-67-64-61-58-55-52-49-46-44-42-40-38-36-34-32-29-26-23-20-17-14-11-8-5-2/h16,18-19,21,25,27-28,30,33,35,39,41,50,53,59,62,78H,4-15,17,20,22-24,26,29,31-32,34,36-38,40,42-49,51-52,54-58,60-61,63-77H2,1-3H3,(H,82,83)(H,86,87)/p-1/b19-16-,21-18-,28-25-,30-27-,35-33-,41-39-,53-50-,62-59-/t78-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C81H144NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-39-41-43-45-48-51-54-57-60-63-66-69-72-80(84)88-76-78(77-90-92(86,87)89-75-74-82-79(83)71-68-65-62-59-56-53-50-47-30-27-24-21-18-15-12-9-6-3)91-81(85)73-70-67-64-61-58-55-52-49-46-44-42-40-38-36-34-32-29-26-23-20-17-14-11-8-5-2/h16,18-19,21,25,27-28,30,33,35,39,41,50,53,59,62,78H,4-15,17,20,22-24,26,29,31-32,34,36-38,40,42-49,51-52,54-58,60-61,63-77H2,1-3H3,(H,82,83)(H,86,87)/b19-16-,21-18-,28-25-,30-27-,35-33-,41-39-,53-50-,62-59-/t78-/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:25]=[CH:28]\[CH2:31]/[CH:33]=[CH:35]\[CH2:37]/[CH:39]=[CH:41]\[CH2:43][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][CH2:72][C:80](=[O:84])[O:88][CH2:76][C@H:78]([CH2:77][O:90][P:92]([OH:86])(=[O:87])[O:89][CH2:75][CH2:74][N:82]=[C:79]([CH2:71][CH2:68][CH2:65]/[CH:62]=[CH:59]\[CH2:56]/[CH:53]=[CH:50]\[CH2:47]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:83])[O:91][C:81]([CH2:73][CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:85] |
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