| Properties | Image |
MNX_ID | MNXM219466 |
 |
reference | slm:000300976 |
formula | C75H132O6 |
global charge | 0 |
mol weight | 1129.875 |
InChIKey | STHYKKNOZJTTAU-KFETVZLHSA-N |
InChI | InChI=1S/C75H132O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-37-39-41-44-47-50-53-56-59-62-65-68-74(77)80-71-72(70-79-73(76)67-64-61-58-55-52-49-46-43-40-33-30-27-24-21-18-15-12-9-6-3)81-75(78)69-66-63-60-57-54-51-48-45-42-38-35-32-29-26-23-20-17-14-11-8-5-2/h17-18,20-21,26-27,29-30,35,38,45,48,54,57,72H,4-16,19,22-25,28,31-34,36-37,39-44,46-47,49-53,55-56,58-71H2,1-3H3/b20-17-,21-18-,29-26-,30-27-,38-35-,48-45-,57-54-/t72-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C75H132O6/c1-4-7-10-13-16-19-22-25-28-31-34-36-37-39-41-44-47-50-53-56-59-62-65-68-74(77)80-71-72(70-79-73(76)67-64-61-58-55-52-49-46-43-40-33-30-27-24-21-18-15-12-9-6-3)81-75(78)69-66-63-60-57-54-51-48-45-42-38-35-32-29-26-23-20-17-14-11-8-5-2/h17-18,20-21,26-27,29-30,35,38,45,48,54,57,72H,4-16,19,22-25,28,31-34,36-37,39-44,46-47,49-53,55-56,58-71H2,1-3H3/b20-17-,21-18-,29-26-,30-27-,38-35-,48-45-,57-54-/t72-/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][CH2:31][CH2:34][CH2:36][CH2:37][CH2:39][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][C:74](=[O:77])[O:80][CH2:71][C@@H:72]([CH2:70][O:79][C:73]([CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:33]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:76])[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: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:78] |
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