| Properties | Image |
|---|
| MNX_ID | MNXM176450 |
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| reference | slm:000130635 |
| formula | C49H86O6 |
| global charge | 0 |
| mol weight | 771.221 |
| InChIKey | ZTQQETSEVSDWIA-SRAVIXMUSA-N |
| InChI | InChI=1S/C49H86O6/c1-4-7-10-13-16-19-22-24-27-30-33-36-39-42-48(51)54-45-46(44-53-47(50)41-38-35-32-29-26-21-18-15-12-9-6-3)55-49(52)43-40-37-34-31-28-25-23-20-17-14-11-8-5-2/h10-11,13-14,19-20,22-23,46H,4-9,12,15-18,21,24-45H2,1-3H3/b13-10-,14-11-,22-19-,23-20-/t46-/m0/s1 |
| SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCC |
MNX internals
| InChI (mnx) | InChI=1/C49H86O6/c1-4-7-10-13-16-19-22-24-27-30-33-36-39-42-48(51)54-45-46(44-53-47(50)41-38-35-32-29-26-21-18-15-12-9-6-3)55-49(52)43-40-37-34-31-28-25-23-20-17-14-11-8-5-2/h10-11,13-14,19-20,22-23,46H,4-9,12,15-18,21,24-45H2,1-3H3/b13-10-,14-11-,22-19-,23-20-/t46-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7]/[CH:10]=[CH:13]\[CH2:16]/[CH:19]=[CH:22]\[CH2:24][CH2:27][CH2:30][CH2:33][CH2:36][CH2:39][CH2:42][C:48](=[O:51])[O:54][CH2:45][C@H:46]([CH2:44][O:53][C:47]([CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:26][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:50])[O:55][C:49]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:28][CH2:25]/[CH:23]=[CH:20]\[CH2:17]/[CH:14]=[CH:11]\[CH2:8][CH2:5][CH3:2])=[O:52] |
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