| Properties | Image |
|---|
| MNX_ID | MNXM363706 |
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| reference | slm:000280686 |
| formula | C69H122O6 |
| global charge | 0 |
| mol weight | 1047.729 |
| InChIKey | QWOQNKMKVQRHPM-QWLKFXAMSA-N |
| InChI | InChI=1S/C69H122O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-37-39-42-44-47-50-53-56-59-62-68(71)74-65-66(75-69(72)63-60-57-54-51-48-45-40-27-24-21-18-15-12-9-6-3)64-73-67(70)61-58-55-52-49-46-43-41-38-36-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,36,38,43,46,66H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-35,37,39-42,44-45,47-65H2,1-3H3/b11-8-,20-17-,24-21-,29-26-,38-36-,46-43-/t66-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H122O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-37-39-42-44-47-50-53-56-59-62-68(71)74-65-66(75-69(72)63-60-57-54-51-48-45-40-27-24-21-18-15-12-9-6-3)64-73-67(70)61-58-55-52-49-46-43-41-38-36-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,36,38,43,46,66H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-35,37,39-42,44-45,47-65H2,1-3H3/b11-8-,20-17-,24-21-,29-26-,38-36-,46-43-/t66-/m0/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][CH2:37][CH2:39][CH2:42][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][C:68](=[O:71])[O:74][CH2:65][C@H:66]([CH2:64][O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49]/[CH:46]=[CH:43]\[CH2:41]/[CH:38]=[CH:36]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:70])[O:75][C:69]([CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:40][CH2:27]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:72] |
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