| Properties | Image |
|---|
| MNX_ID | MNXM348137 |
 |
| reference | slm:000265149 |
| formula | C67H114O6 |
| global charge | 0 |
| mol weight | 1015.643 |
| InChIKey | BPJDAXOUYYQDGT-PRCBKRAZSA-N |
| InChI | InChI=1S/C67H114O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-35-37-40-42-45-48-51-54-57-60-66(69)72-63-64(73-67(70)61-58-55-52-49-46-43-38-27-24-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-41-39-36-34-31-29-26-23-20-17-14-11-8-5-2/h9,12,16,18-19,21,25,27-28,32-33,37-38,40,45,48,64H,4-8,10-11,13-15,17,20,22-24,26,29-31,34-36,39,41-44,46-47,49-63H2,1-3H3/b12-9-,19-16-,21-18-,28-25-,33-32-,38-27-,40-37-,48-45-/t64-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C67H114O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-35-37-40-42-45-48-51-54-57-60-66(69)72-63-64(73-67(70)61-58-55-52-49-46-43-38-27-24-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-41-39-36-34-31-29-26-23-20-17-14-11-8-5-2/h9,12,16,18-19,21,25,27-28,32-33,37-38,40,45,48,64H,4-8,10-11,13-15,17,20,22-24,26,29-31,34-36,39,41-44,46-47,49-63H2,1-3H3/b12-9-,19-16-,21-18-,28-25-,33-32-,38-27-,40-37-,48-45-/t64-/m1/s1 |
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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]\[CH2:30]/[CH:32]=[CH:33]\[CH2:35]/[CH:37]=[CH:40]\[CH2:42]/[CH:45]=[CH:48]\[CH2:51][CH2:54][CH2:57][CH2:60][C:66](=[O:69])[O:72][CH2:63][C@@H:64]([CH2:62][O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:39][CH2:36][CH2:34][CH2:31][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:68])[O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43]/[CH:38]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:70] |
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