| Properties | Image |
|---|
| MNX_ID | MNXM192863 |
 |
| reference | slm:000187342 |
| formula | C58H110O6 |
| global charge | 0 |
| mol weight | 903.512 |
| InChIKey | IHRJOAWYSNQWMH-PSPRELGPSA-N |
| InChI | InChI=1S/C58H110O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-38-43-47-51-58(61)64-55(53-63-57(60)50-46-42-39-35-36-40-44-48-54(3)4)52-62-56(59)49-45-41-37-33-31-29-27-20-18-16-14-12-10-8-6-2/h16,18,54-55H,5-15,17,19-53H2,1-4H3/b18-16+/t55-/m1/s1 |
| SMILES | CCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C58H110O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-38-43-47-51-58(61)64-55(53-63-57(60)50-46-42-39-35-36-40-44-48-54(3)4)52-62-56(59)49-45-41-37-33-31-29-27-20-18-16-14-12-10-8-6-2/h16,18,54-55H,5-15,17,19-53H2,1-4H3/b18-16+/t55-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:38][CH2:43][CH2:47][CH2:51][C:58](=[O:61])[O:64][C@H:55]([CH2:52][O:62][C:56]([CH2:49][CH2:45][CH2:41][CH2:37][CH2:33][CH2:31][CH2:29][CH2:27][CH2:20]/[CH:18]=[CH:16]/[CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:59])[CH2:53][O:63][C:57]([CH2:50][CH2:46][CH2:42][CH2:39][CH2:35][CH2:36][CH2:40][CH2:44][CH2:48][CH:54]([CH3:3])[CH3:4])=[O:60] |
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