| Properties | Image |
|---|
| MNX_ID | MNXM213454 |
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| reference | slm:000285522 |
| formula | C70H124O6 |
| global charge | 0 |
| mol weight | 1061.756 |
| InChIKey | PQTUQTNNDCRSPR-GXTDJFTQSA-N |
| InChI | InChI=1S/C70H124O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-28-29-30-32-33-35-37-39-41-45-49-53-57-61-68(71)74-64-67(65-75-69(72)62-58-54-50-47-43-44-48-52-56-60-66(3)4)76-70(73)63-59-55-51-46-42-40-38-36-34-31-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,22,26,31,36,38,42,46,66-67H,5-7,9,11-13,15,17-19,21,23-25,27-30,32-35,37,39-41,43-45,47-65H2,1-4H3/b10-8-,16-14-,22-20-,31-26-,38-36-,46-42-/t67-/m0/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)CCCCCCCCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C70H124O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-28-29-30-32-33-35-37-39-41-45-49-53-57-61-68(71)74-64-67(65-75-69(72)62-58-54-50-47-43-44-48-52-56-60-66(3)4)76-70(73)63-59-55-51-46-42-40-38-36-34-31-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,22,26,31,36,38,42,46,66-67H,5-7,9,11-13,15,17-19,21,23-25,27-30,32-35,37,39-41,43-45,47-65H2,1-4H3/b10-8-,16-14-,22-20-,31-26-,38-36-,46-42-/t67-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:45][CH2:49][CH2:53][CH2:57][CH2:61][C:68](=[O:71])[O:74][CH2:64][C@@H:67]([CH2:65][O:75][C:69]([CH2:62][CH2:58][CH2:54][CH2:50][CH2:47][CH2:43][CH2:44][CH2:48][CH2:52][CH2:56][CH2:60][CH:66]([CH3:3])[CH3:4])=[O:72])[O:76][C:70]([CH2:63][CH2:59][CH2:55][CH2:51]/[CH:46]=[CH:42]\[CH2:40]/[CH:38]=[CH:36]\[CH2:34]/[CH:31]=[CH:26]\[CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])=[O:73] |
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