| Properties | Image |
MNX_ID | MNXM178503 |
 |
reference | slm:000300731 |
formula | C75H130O6 |
global charge | 0 |
mol weight | 1127.859 |
InChIKey | MWXRXCHSQUBJMN-KMTUTSBPSA-N |
InChI | InChI=1S/C75H130O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-64-67-73(76)79-70-72(81-75(78)69-66-63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)71-80-74(77)68-65-62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-17,19-20,25-26,28-29,34-35,37-38,43-44,46-47,72H,4-15,18,21-24,27,30-33,36,39-42,45,48-71H2,1-3H3/b19-16-,20-17-,28-25-,29-26-,37-34-,38-35-,46-43-,47-44- |
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)CCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C75H130O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-64-67-73(76)79-70-72(81-75(78)69-66-63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)71-80-74(77)68-65-62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-17,19-20,25-26,28-29,34-35,37-38,43-44,46-47,72H,4-15,18,21-24,27,30-33,36,39-42,45,48-71H2,1-3H3/b19-16-,20-17-,28-25-,29-26-,37-34-,38-35-,46-43-,47-44- |
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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:37]\[CH2:40]/[CH:43]=[CH:46]\[CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][C:73](=[O:76])[O:79][CH2:70][CH:72]([CH2:71][O:80][C:74]([CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50]/[CH:47]=[CH:44]\[CH2:41]/[CH:38]=[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:77])[O:81][C:75]([CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:78] |
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