| Properties | Image |
|---|
| MNX_ID | MNXM321220 |
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| reference | slm:000157338 |
| formula | C55H100O6 |
| global charge | 0 |
| mol weight | 857.399 |
| InChIKey | WUEJDRZHABBYKV-NHQPNNLDSA-N |
| InChI | InChI=1S/C55H100O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-31-36-40-44-48-55(58)61-52(50-60-54(57)47-43-39-35-32-28-29-33-37-41-45-51(3)4)49-59-53(56)46-42-38-34-30-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,22,51-52H,5-7,9,11-13,15,17-19,21,23-50H2,1-4H3/b10-8-,16-14-,22-20-/t52-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H100O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-31-36-40-44-48-55(58)61-52(50-60-54(57)47-43-39-35-32-28-29-33-37-41-45-51(3)4)49-59-53(56)46-42-38-34-30-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,22,51-52H,5-7,9,11-13,15,17-19,21,23-50H2,1-4H3/b10-8-,16-14-,22-20-/t52-/m1/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][CH2:31][CH2:36][CH2:40][CH2:44][CH2:48][C:55](=[O:58])[O:61][C@H:52]([CH2:49][O:59][C:53]([CH2:46][CH2:42][CH2:38][CH2:34][CH2:30][CH2:26][CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])=[O:56])[CH2:50][O:60][C:54]([CH2:47][CH2:43][CH2:39][CH2:35][CH2:32][CH2:28][CH2:29][CH2:33][CH2:37][CH2:41][CH2:45][CH:51]([CH3:3])[CH3:4])=[O:57] |
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