| Properties | Image |
|---|
| MNX_ID | MNXM214121 |
 |
| reference | slm:000158444 |
| formula | C55H102O6 |
| global charge | 0 |
| mol weight | 859.415 |
| InChIKey | GNGVNCGZVYYJGR-GSJCYCFYSA-N |
| InChI | InChI=1S/C55H102O6/c1-5-7-9-11-13-15-17-19-21-23-24-26-30-34-38-42-46-53(56)59-49-52(50-60-54(57)47-43-39-35-32-28-29-33-37-41-45-51(3)4)61-55(58)48-44-40-36-31-27-25-22-20-18-16-14-12-10-8-6-2/h16,18,20,22,51-52H,5-15,17,19,21,23-50H2,1-4H3/b18-16+,22-20-/t52-/m0/s1 |
| SMILES | CCCCCC/C=C/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C55H102O6/c1-5-7-9-11-13-15-17-19-21-23-24-26-30-34-38-42-46-53(56)59-49-52(50-60-54(57)47-43-39-35-32-28-29-33-37-41-45-51(3)4)61-55(58)48-44-40-36-31-27-25-22-20-18-16-14-12-10-8-6-2/h16,18,20,22,51-52H,5-15,17,19,21,23-50H2,1-4H3/b18-16+,22-20-/t52-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:24][CH2:26][CH2:30][CH2:34][CH2:38][CH2:42][CH2:46][C:53](=[O:56])[O:59][CH2:49][C@@H:52]([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])[O:61][C:55]([CH2:48][CH2:44][CH2:40][CH2:36][CH2:31][CH2:27][CH2:25]/[CH:22]=[CH:20]\[CH:18]=[CH:16]\[CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:58] |
|