| Properties | Image |
|---|
| MNX_ID | MNXM352462 |
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| reference | slm:000146442 |
| formula | C53H100O6 |
| global charge | 0 |
| mol weight | 833.377 |
| InChIKey | ZHOYCWPLUHWAJA-CKWAXFGSSA-N |
| InChI | InChI=1S/C53H100O6/c1-4-7-10-13-16-19-21-22-23-24-25-26-27-28-29-30-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-31-20-17-14-11-8-5-2/h14,17,50H,4-13,15-16,18-49H2,1-3H3/b17-14-/t50-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H100O6/c1-4-7-10-13-16-19-21-22-23-24-25-26-27-28-29-30-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-18-15-12-9-6-3)49-58-52(55)46-43-40-37-34-31-20-17-14-11-8-5-2/h14,17,50H,4-13,15-16,18-49H2,1-3H3/b17-14-/t50-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][C:53](=[O:56])[O:59][C@H:50]([CH2:48][O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:54])[CH2:49][O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:20]/[CH:17]=[CH:14]\[CH2:11][CH2:8][CH2:5][CH3:2])=[O:55] |
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