| Properties | Image |
|---|
| MNX_ID | MNXM963651 |
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| reference | slm:000656036 |
| formula | C79H145NO9P |
| global charge | -1 |
| mol weight | 1284.001 |
| InChIKey | LJCQISKXPGPIIT-PYYHLWLHSA-M |
| InChI | InChI=1S/C79H146NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-42-44-46-49-52-55-58-61-64-67-70-78(82)86-74-76(75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-27-24-21-18-15-12-9-6-3)89-79(83)71-68-65-62-59-56-53-50-47-45-43-41-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h16,19,21,24-25,28,32,34,38,40,76H,4-15,17-18,20,22-23,26-27,29-31,33,35-37,39,41-75H2,1-3H3,(H,80,81)(H,84,85)/p-1/b19-16-,24-21-,28-25-,34-32-,40-38-/t76-/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)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C79H146NO9P/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-40-42-44-46-49-52-55-58-61-64-67-70-78(82)86-74-76(75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-27-24-21-18-15-12-9-6-3)89-79(83)71-68-65-62-59-56-53-50-47-45-43-41-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h16,19,21,24-25,28,32,34,38,40,76H,4-15,17-18,20,22-23,26-27,29-31,33,35-37,39,41-75H2,1-3H3,(H,80,81)(H,84,85)/b19-16-,24-21-,28-25-,34-32-,40-38-/t76-/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]\[CH2:30]/[CH:32]=[CH:34]\[CH2:36]/[CH:38]=[CH:40]\[CH2:42][CH2:44][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][CH2:70][C:78](=[O:82])[O:86][CH2:74][C@H:76]([CH2:75][O:88][P:90]([OH:84])(=[O:85])[O:87][CH2:73][CH2:72][N:80]=[C:77]([CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:27]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:81])[O:89][C:79]([CH2:71][CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:83] |
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