| Properties | Image |
|---|
| MNX_ID | MNXM939251 |
 |
| reference | slm:000631636 |
| formula | C81H137NO9P |
| global charge | -1 |
| mol weight | 1299.959 |
| InChIKey | KWLKVLCWSRZRBN-OGEVTRQMSA-M |
| InChI | InChI=1S/C81H138NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-39-41-42-44-46-48-50-52-54-56-58-60-62-64-66-69-72-80(84)88-76-78(77-90-92(86,87)89-75-74-82-79(83)71-68-9-6-3)91-81(85)73-70-67-65-63-61-59-57-55-53-51-49-47-45-43-40-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-35,40,43,78H,4-6,9,12-13,18-19,24-25,30-31,36-39,41-42,44-77H2,1-3H3,(H,82,83)(H,86,87)/p-1/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,35-33-,43-40-/t78-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCCNC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C81H138NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-39-41-42-44-46-48-50-52-54-56-58-60-62-64-66-69-72-80(84)88-76-78(77-90-92(86,87)89-75-74-82-79(83)71-68-9-6-3)91-81(85)73-70-67-65-63-61-59-57-55-53-51-49-47-45-43-40-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-35,40,43,78H,4-6,9,12-13,18-19,24-25,30-31,36-39,41-42,44-77H2,1-3H3,(H,82,83)(H,86,87)/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,35-33-,43-40-/t78-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:36][CH2:38][CH2:39][CH2:41][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][CH2:60][CH2:62][CH2:64][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][CH2:9][CH2:6][CH3:3])[OH:83])[O:91][C:81]([CH2:73][CH2:70][CH2:67][CH2:65][CH2:63][CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47][CH2:45]/[CH:43]=[CH:40]\[CH2:37]/[CH:35]=[CH:33]\[CH2:31]/[CH:29]=[CH:27]\[CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:85] |
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