| Properties | Image |
MNX_ID | MNXM190875 |
 |
reference | slm:000301172 |
formula | C75H132O6 |
global charge | 0 |
mol weight | 1129.875 |
InChIKey | DVDJLHWOVHIILY-NXDZONSGSA-N |
InChI | InChI=1S/C75H132O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-36-37-38-39-41-42-44-47-50-53-56-59-62-65-68-74(77)80-71-72(70-79-73(76)67-64-61-58-55-52-49-46-27-24-21-18-15-12-9-6-3)81-75(78)69-66-63-60-57-54-51-48-45-43-40-33-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,33,40,45,48,54,57,72H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-32,34-39,41-44,46-47,49-53,55-56,58-71H2,1-3H3/b11-8-,20-17-,24-21+,29-26-,40-33-,48-45-,57-54-/t72-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C75H132O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-36-37-38-39-41-42-44-47-50-53-56-59-62-65-68-74(77)80-71-72(70-79-73(76)67-64-61-58-55-52-49-46-27-24-21-18-15-12-9-6-3)81-75(78)69-66-63-60-57-54-51-48-45-43-40-33-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,33,40,45,48,54,57,72H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-32,34-39,41-44,46-47,49-53,55-56,58-71H2,1-3H3/b11-8-,20-17-,24-21+,29-26-,40-33-,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][CH2:30][CH2:32][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:41][CH2:42][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][CH2:27]/[CH:24]=[CH:21]/[CH2:18][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]\[CH2:43]/[CH:40]=[CH:33]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:78] |
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