| Properties | Image |
|---|
| MNX_ID | MNXM235499 |
 |
| reference | slm:000305738 |
| formula | C79H142O6 |
| global charge | 0 |
| mol weight | 1187.999 |
| InChIKey | USBWEFZWGMKSBU-QYGMFFHQSA-N |
| InChI | InChI=1S/C79H142O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-38-39-40-43-45-48-51-54-57-60-63-66-69-72-78(81)84-75-76(85-79(82)73-70-67-64-61-58-55-52-49-46-42-36-33-30-27-24-21-18-15-12-9-6-3)74-83-77(80)71-68-65-62-59-56-53-50-47-44-41-35-32-29-26-23-20-17-14-11-8-5-2/h9,12,18,21,26-27,29-30,36,42,49,52,76H,4-8,10-11,13-17,19-20,22-25,28,31-35,37-41,43-48,50-51,53-75H2,1-3H3/b12-9-,21-18-,29-26-,30-27-,42-36-,52-49-/t76-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C79H142O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-38-39-40-43-45-48-51-54-57-60-63-66-69-72-78(81)84-75-76(85-79(82)73-70-67-64-61-58-55-52-49-46-42-36-33-30-27-24-21-18-15-12-9-6-3)74-83-77(80)71-68-65-62-59-56-53-50-47-44-41-35-32-29-26-23-20-17-14-11-8-5-2/h9,12,18,21,26-27,29-30,36,42,49,52,76H,4-8,10-11,13-17,19-20,22-25,28,31-35,37-41,43-48,50-51,53-75H2,1-3H3/b12-9-,21-18-,29-26-,30-27-,42-36-,52-49-/t76-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH2:34][CH2:37][CH2:38][CH2:39][CH2:40][CH2:43][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][CH2:69][CH2:72][C:78](=[O:81])[O:84][CH2:75][C@@H:76]([CH2:74][O:83][C:77]([CH2:71][CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:35][CH2:32]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:80])[O:85][C:79]([CH2:73][CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55]/[CH:52]=[CH:49]\[CH2:46]/[CH:42]=[CH:36]\[CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:82] |
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