| Properties | Image |
|---|
| MNX_ID | MNXM187227 |
 |
| reference | slm:000132841 |
| formula | C50H88O6 |
| global charge | 0 |
| mol weight | 785.248 |
| InChIKey | IORLRMDNUUGYFH-WGAPPTFMSA-N |
| InChI | InChI=1S/C50H88O6/c1-5-7-9-11-13-15-17-19-20-22-24-26-30-35-39-43-50(53)56-47(45-55-49(52)42-38-34-31-27-28-32-36-40-46(3)4)44-54-48(51)41-37-33-29-25-23-21-18-16-14-12-10-8-6-2/h7,9,13,15,19-20,24,26,46-47H,5-6,8,10-12,14,16-18,21-23,25,27-45H2,1-4H3/b9-7-,15-13-,20-19-,26-24-/t47-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C50H88O6/c1-5-7-9-11-13-15-17-19-20-22-24-26-30-35-39-43-50(53)56-47(45-55-49(52)42-38-34-31-27-28-32-36-40-46(3)4)44-54-48(51)41-37-33-29-25-23-21-18-16-14-12-10-8-6-2/h7,9,13,15,19-20,24,26,46-47H,5-6,8,10-12,14,16-18,21-23,25,27-45H2,1-4H3/b9-7-,15-13-,20-19-,26-24-/t47-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:20]\[CH2:22]/[CH:24]=[CH:26]\[CH2:30][CH2:35][CH2:39][CH2:43][C:50](=[O:53])[O:56][C@@H:47]([CH2:44][O:54][C:48]([CH2:41][CH2:37][CH2:33][CH2:29][CH2:25][CH2:23][CH2:21][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:51])[CH2:45][O:55][C:49]([CH2:42][CH2:38][CH2:34][CH2:31][CH2:27][CH2:28][CH2:32][CH2:36][CH2:40][CH:46]([CH3:3])[CH3:4])=[O:52] |
|