| Properties | Image |
|---|
| MNX_ID | MNXM965652 |
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| reference | slm:000658037 |
| formula | C72H125NO9P |
| global charge | -1 |
| mol weight | 1179.764 |
| InChIKey | INNKDPSKMMMBRW-KDBPZQLUSA-M |
| InChI | InChI=1S/C72H126NO9P/c1-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-42-46-50-54-58-62-71(75)79-66-69(82-72(76)63-59-55-51-47-43-39-40-44-48-52-56-60-68(3)4)67-81-83(77,78)80-65-64-73-70(74)61-57-53-49-45-41-37-35-33-22-20-18-16-14-12-10-8-6-2/h13-16,19-22,24-25,27-28,35,37,45,49,68-69H,5-12,17-18,23,26,29-34,36,38-44,46-48,50-67H2,1-4H3,(H,73,74)(H,77,78)/p-1/b15-13-,16-14-,21-19-,22-20-,25-24-,28-27-,37-35-,49-45-/t69-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C72H126NO9P/c1-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-42-46-50-54-58-62-71(75)79-66-69(82-72(76)63-59-55-51-47-43-39-40-44-48-52-56-60-68(3)4)67-81-83(77,78)80-65-64-73-70(74)61-57-53-49-45-41-37-35-33-22-20-18-16-14-12-10-8-6-2/h13-16,19-22,24-25,27-28,35,37,45,49,68-69H,5-12,17-18,23,26,29-34,36,38-44,46-48,50-67H2,1-4H3,(H,73,74)(H,77,78)/b15-13-,16-14-,21-19-,22-20-,25-24-,28-27-,37-35-,49-45-/t69-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][CH2:30][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:42][CH2:46][CH2:50][CH2:54][CH2:58][CH2:62][C:71](=[O:75])[O:79][CH2:66][C@H:69]([CH2:67][O:81][P:83]([OH:77])(=[O:78])[O:80][CH2:65][CH2:64][N:73]=[C:70]([CH2:61][CH2:57][CH2:53]/[CH:49]=[CH:45]\[CH2:41]/[CH:37]=[CH:35]\[CH2:33]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:74])[O:82][C:72]([CH2:63][CH2:59][CH2:55][CH2:51][CH2:47][CH2:43][CH2:39][CH2:40][CH2:44][CH2:48][CH2:52][CH2:56][CH2:60][CH:68]([CH3:3])[CH3:4])=[O:76] |
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