| Properties | Image |
MNX_ID | MNXM191259 |
 |
reference | slm:000297258 |
formula | C73H130O6 |
global charge | 0 |
mol weight | 1103.837 |
InChIKey | OTFIJTJCKQLBHC-QBBZPXNHSA-N |
InChI | InChI=1S/C73H130O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-41-42-45-48-51-54-57-60-63-66-72(75)78-69-70(68-77-71(74)65-62-59-56-53-50-47-44-27-24-21-18-15-12-9-6-3)79-73(76)67-64-61-58-55-52-49-46-43-40-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,40,43,49,52,70H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-39,41-42,44-48,50-51,53-69H2,1-3H3/b11-8-,20-17-,24-21+,29-26-,43-40-,52-49-/t70-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C73H130O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-37-38-39-41-42-45-48-51-54-57-60-63-66-72(75)78-69-70(68-77-71(74)65-62-59-56-53-50-47-44-27-24-21-18-15-12-9-6-3)79-73(76)67-64-61-58-55-52-49-46-43-40-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,40,43,49,52,70H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-39,41-42,44-48,50-51,53-69H2,1-3H3/b11-8-,20-17-,24-21+,29-26-,43-40-,52-49-/t70-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:30][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:41][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][CH2:66][C:72](=[O:75])[O:78][CH2:69][C@@H:70]([CH2:68][O:77][C:71]([CH2:65][CH2:62][CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:27]/[CH:24]=[CH:21]/[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:74])[O:79][C:73]([CH2:67][CH2:64][CH2:61][CH2:58][CH2:55]/[CH:52]=[CH:49]\[CH2:46]/[CH:43]=[CH:40]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:76] |
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