| Properties | Image |
|---|
| MNX_ID | MNXM234375 |
 |
| reference | slm:000303955 |
| formula | C77H136O6 |
| global charge | 0 |
| mol weight | 1157.929 |
| InChIKey | XPWYUDIPHOHBJD-YGJZRWDYSA-N |
| InChI | InChI=1S/C77H136O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-38-41-44-47-50-53-56-59-62-65-68-71-77(80)83-74(72-81-75(78)69-66-63-60-57-54-51-48-45-42-39-35-32-29-26-23-20-17-14-11-8-5-2)73-82-76(79)70-67-64-61-58-55-52-49-46-43-40-36-33-30-27-24-21-18-15-12-9-6-3/h17,20,25-30,35,39,45,48,54,57,74H,4-16,18-19,21-24,31-34,36-38,40-44,46-47,49-53,55-56,58-73H2,1-3H3/b20-17-,28-25-,29-26-,30-27-,39-35-,48-45-,57-54-/t74-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C77H136O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-38-41-44-47-50-53-56-59-62-65-68-71-77(80)83-74(72-81-75(78)69-66-63-60-57-54-51-48-45-42-39-35-32-29-26-23-20-17-14-11-8-5-2)73-82-76(79)70-67-64-61-58-55-52-49-46-43-40-36-33-30-27-24-21-18-15-12-9-6-3/h17,20,25-30,35,39,45,48,54,57,74H,4-16,18-19,21-24,31-34,36-38,40-44,46-47,49-53,55-56,58-73H2,1-3H3/b20-17-,28-25-,29-26-,30-27-,39-35-,48-45-,57-54-/t74-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:31][CH2:34][CH2:37][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][C:77](=[O:80])[O:83][C@@H:74]([CH2:72][O:81][C:75]([CH2:69][CH2:66][CH2:63][CH2:60]/[CH:57]=[CH:54]\[CH2:51]/[CH:48]=[CH:45]\[CH2:42]/[CH:39]=[CH:35]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:78])[CH2:73][O:82][C:76]([CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:36][CH2:33]/[CH:30]=[CH:27]\[CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:79] |
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