| Properties | Image |
|---|
| MNX_ID | MNXM187193 |
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| reference | slm:000130658 |
| formula | C49H86O6 |
| global charge | 0 |
| mol weight | 771.221 |
| InChIKey | DMYMVKLRSHNPID-JFXHGDHRSA-N |
| InChI | InChI=1S/C49H86O6/c1-6-7-8-9-10-11-12-13-14-15-16-19-25-31-36-41-49(52)55-46(43-54-48(51)40-35-30-26-21-23-28-33-38-45(4)5)42-53-47(50)39-34-29-24-20-17-18-22-27-32-37-44(2)3/h7-8,10-11,13-14,16,19,44-46H,6,9,12,15,17-18,20-43H2,1-5H3/b8-7-,11-10-,14-13-,19-16-/t46-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C49H86O6/c1-6-7-8-9-10-11-12-13-14-15-16-19-25-31-36-41-49(52)55-46(43-54-48(51)40-35-30-26-21-23-28-33-38-45(4)5)42-53-47(50)39-34-29-24-20-17-18-22-27-32-37-44(2)3/h7-8,10-11,13-14,16,19,44-46H,6,9,12,15,17-18,20-43H2,1-5H3/b8-7-,11-10-,14-13-,19-16-/t46-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:19]\[CH2:25][CH2:31][CH2:36][CH2:41][C:49](=[O:52])[O:55][C@@H:46]([CH2:42][O:53][C:47]([CH2:39][CH2:34][CH2:29][CH2:24][CH2:20][CH2:17][CH2:18][CH2:22][CH2:27][CH2:32][CH2:37][CH:44]([CH3:2])[CH3:3])=[O:50])[CH2:43][O:54][C:48]([CH2:40][CH2:35][CH2:30][CH2:26][CH2:21][CH2:23][CH2:28][CH2:33][CH2:38][CH:45]([CH3:4])[CH3:5])=[O:51] |
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