| Properties | Image |
|---|
| MNX_ID | MNXM954872 |
 |
| reference | slm:000647257 |
| formula | C77H129NO9P |
| global charge | -1 |
| mol weight | 1243.851 |
| InChIKey | JKZDQCXBACRBJM-TZCDSFFJSA-M |
| InChI | InChI=1S/C77H130NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-42-45-48-51-54-57-60-63-66-69-77(81)87-74(72-84-76(80)68-65-62-59-56-53-50-47-44-41-32-29-26-23-20-17-14-11-8-5-2)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-43-30-27-24-21-18-15-12-9-6-3/h16-21,25-30,33-34,36-37,39-40,46,49,55,58,74H,4-15,22-24,31-32,35,38,41-45,47-48,50-54,56-57,59-73H2,1-3H3,(H,78,79)(H,82,83)/p-1/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,34-33-,37-36-,40-39-,49-46-,58-55-/t74-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C77H130NO9P/c1-4-7-10-13-16-19-22-25-28-31-33-34-35-36-37-38-39-40-42-45-48-51-54-57-60-63-66-69-77(81)87-74(72-84-76(80)68-65-62-59-56-53-50-47-44-41-32-29-26-23-20-17-14-11-8-5-2)73-86-88(82,83)85-71-70-78-75(79)67-64-61-58-55-52-49-46-43-30-27-24-21-18-15-12-9-6-3/h16-21,25-30,33-34,36-37,39-40,46,49,55,58,74H,4-15,22-24,31-32,35,38,41-45,47-48,50-54,56-57,59-73H2,1-3H3,(H,78,79)(H,82,83)/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,34-33-,37-36-,40-39-,49-46-,58-55-/t74-/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]\[CH2:35]/[CH:36]=[CH:37]\[CH2:38]/[CH:39]=[CH:40]\[CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][C:77](=[O:81])[O:87][C@H:74]([CH2:72][O:84][C:76]([CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:80])[CH2:73][O:86][P:88]([OH:82])(=[O:83])[O:85][CH2:71][CH2:70][N:78]=[C:75]([CH2:67][CH2:64][CH2:61]/[CH:58]=[CH:55]\[CH2:52]/[CH:49]=[CH:46]\[CH2:43]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:79] |
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