| Properties | Image |
|---|
| MNX_ID | MNXM215115 |
 |
| reference | slm:000133816 |
| formula | C50H92O6 |
| global charge | 0 |
| mol weight | 789.28 |
| InChIKey | NMFZNGUREDGCCB-JUJJDSBDSA-N |
| InChI | InChI=1S/C50H92O6/c1-5-7-9-11-13-15-17-19-21-25-29-33-37-41-48(51)54-44-47(45-55-49(52)42-38-34-30-27-23-24-28-32-36-40-46(3)4)56-50(53)43-39-35-31-26-22-20-18-16-14-12-10-8-6-2/h9,11,15,17,46-47H,5-8,10,12-14,16,18-45H2,1-4H3/b11-9-,17-15-/t47-/m0/s1 |
| SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C50H92O6/c1-5-7-9-11-13-15-17-19-21-25-29-33-37-41-48(51)54-44-47(45-55-49(52)42-38-34-30-27-23-24-28-32-36-40-46(3)4)56-50(53)43-39-35-31-26-22-20-18-16-14-12-10-8-6-2/h9,11,15,17,46-47H,5-8,10,12-14,16,18-45H2,1-4H3/b11-9-,17-15-/t47-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7]/[CH:9]=[CH:11]\[CH2:13]/[CH:15]=[CH:17]\[CH2:19][CH2:21][CH2:25][CH2:29][CH2:33][CH2:37][CH2:41][C:48](=[O:51])[O:54][CH2:44][C@@H:47]([CH2:45][O:55][C:49]([CH2:42][CH2:38][CH2:34][CH2:30][CH2:27][CH2:23][CH2:24][CH2:28][CH2:32][CH2:36][CH2:40][CH:46]([CH3:3])[CH3:4])=[O:52])[O:56][C:50]([CH2:43][CH2:39][CH2:35][CH2:31][CH2:26][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:53] |
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