| Properties | Image |
MNX_ID | MNXM178495 |
 |
reference | slm:000292741 |
formula | C72H124O6 |
global charge | 0 |
mol weight | 1085.778 |
InChIKey | QXIANOHTLXRGAX-COVYIHSUSA-N |
InChI | InChI=1S/C72H124O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-41-43-46-49-52-55-58-61-64-70(73)76-67-69(78-72(75)66-63-60-57-54-51-48-45-40-33-30-27-24-21-18-15-12-9-6-3)68-77-71(74)65-62-59-56-53-50-47-44-42-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h16-17,19-20,25-26,28-29,34-37,41-44,69H,4-15,18,21-24,27,30-33,38-40,45-68H2,1-3H3/b19-16-,20-17-,28-25-,29-26-,36-34-,37-35-,43-41-,44-42- |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C72H124O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-38-41-43-46-49-52-55-58-61-64-70(73)76-67-69(78-72(75)66-63-60-57-54-51-48-45-40-33-30-27-24-21-18-15-12-9-6-3)68-77-71(74)65-62-59-56-53-50-47-44-42-39-37-35-32-29-26-23-20-17-14-11-8-5-2/h16-17,19-20,25-26,28-29,34-37,41-44,69H,4-15,18,21-24,27,30-33,38-40,45-68H2,1-3H3/b19-16-,20-17-,28-25-,29-26-,36-34-,37-35-,43-41-,44-42- |
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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:34]=[CH:36]\[CH2:38]/[CH:41]=[CH:43]\[CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][C:70](=[O:73])[O:76][CH2:67][CH:69]([CH2:68][O:77][C:71]([CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47]/[CH:44]=[CH:42]\[CH2:39]/[CH:37]=[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:74])[O:78][C:72]([CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:40][CH2:33][CH2:30][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:75] |
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