| Properties | Image |
|---|
| MNX_ID | MNXM962177 |
 |
| reference | slm:000654562 |
| formula | C70H117NO9P |
| global charge | -1 |
| mol weight | 1147.678 |
| InChIKey | RITFCUMMOZQGDH-ZONMZPHJSA-M |
| InChI | InChI=1S/C70H118NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-36-38-41-43-46-49-52-55-58-61-69(73)77-65-67(80-70(74)62-59-56-53-50-47-44-40-30-27-24-21-18-15-12-9-6-3)66-79-81(75,76)78-64-63-71-68(72)60-57-54-51-48-45-42-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-20,25-26,28-29,33-35,37-38,41-42,45,51,54,67H,4-7,9-10,12-15,18,21-24,27,30-32,36,39-40,43-44,46-50,52-53,55-66H2,1-3H3,(H,71,72)(H,75,76)/p-1/b11-8-,19-16-,20-17-,28-25-,29-26-,34-33-,37-35-,41-38-,45-42-,54-51-/t67-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C70H118NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-36-38-41-43-46-49-52-55-58-61-69(73)77-65-67(80-70(74)62-59-56-53-50-47-44-40-30-27-24-21-18-15-12-9-6-3)66-79-81(75,76)78-64-63-71-68(72)60-57-54-51-48-45-42-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h8,11,16-17,19-20,25-26,28-29,33-35,37-38,41-42,45,51,54,67H,4-7,9-10,12-15,18,21-24,27,30-32,36,39-40,43-44,46-50,52-53,55-66H2,1-3H3,(H,71,72)(H,75,76)/b11-8-,19-16-,20-17-,28-25-,29-26-,34-33-,37-35-,41-38-,45-42-,54-51-/t67-/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:34]\[CH2:36]/[CH:38]=[CH:41]\[CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][C:69](=[O:73])[O:77][CH2:65][C@H:67]([CH2:66][O:79][P:81]([OH:75])(=[O:76])[O:78][CH2:64][CH2:63][N:71]=[C:68]([CH2:60][CH2:57]/[CH:54]=[CH:51]\[CH2:48]/[CH:45]=[CH:42]\[CH2:39]/[CH:37]=[CH:35]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:72])[O:80][C:70]([CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:40][CH2:30][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:74] |
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