| Properties | Image |
|---|
| MNX_ID | MNXM325602 |
 |
| reference | slm:000162746 |
| formula | C56H98O6 |
| global charge | 0 |
| mol weight | 867.394 |
| InChIKey | XHMKPTBANVMLBL-UBBZZKKISA-N |
| InChI | InChI=1S/C56H98O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-33-35-38-41-44-47-50-56(59)62-53(51-60-54(57)48-45-42-39-36-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-34-32-30-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28-30,53H,4-15,18,21-23,27,31-52H2,1-3H3/b19-16-,20-17-,26-24-,29-28-,30-25-/t53-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C56H98O6/c1-4-7-10-13-16-19-22-24-26-27-28-29-31-33-35-38-41-44-47-50-56(59)62-53(51-60-54(57)48-45-42-39-36-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-34-32-30-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28-30,53H,4-15,18,21-23,27,31-52H2,1-3H3/b19-16-,20-17-,26-24-,29-28-,30-25-/t53-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:31][CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][C:56](=[O:59])[O:62][C@@H:53]([CH2:51][O:60][C:54]([CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:57])[CH2:52][O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:32]/[CH:30]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:58] |
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