| Properties | Image |
|---|
| MNX_ID | MNXM365018 |
 |
| reference | slm:000267791 |
| formula | C67H118O6 |
| global charge | 0 |
| mol weight | 1019.675 |
| InChIKey | AMUMNEGSCJKSAX-ASZPVVDJSA-N |
| InChI | InChI=1S/C67H118O6/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-37-40-42-45-48-51-54-57-60-66(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)59-56-53-50-47-44-41-39-36-29-26-23-20-17-14-11-8-5-2/h8,11,17,20,26,29,39,41,46-47,49-50,64H,4-7,9-10,12-16,18-19,21-25,27-28,30-38,40,42-45,48,51-63H2,1-3H3/b11-8-,20-17-,29-26-,41-39-,49-46-,50-47-/t64-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCC/C=C\CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C67H118O6/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-37-40-42-45-48-51-54-57-60-66(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)59-56-53-50-47-44-41-39-36-29-26-23-20-17-14-11-8-5-2/h8,11,17,20,26,29,39,41,46-47,49-50,64H,4-7,9-10,12-16,18-19,21-25,27-28,30-38,40,42-45,48,51-63H2,1-3H3/b11-8-,20-17-,29-26-,41-39-,49-46-,50-47-/t64-/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][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:37][CH2:40][CH2:42][CH2:45][CH2:48][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]/[CH:50]=[CH:47]\[CH2:44]/[CH:41]=[CH:39]\[CH2:36]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:68])[O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52]/[CH:49]=[CH:46]\[CH2:43][CH2:38][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:70] |
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