| Properties | Image |
|---|
| MNX_ID | MNXM317122 |
 |
| reference | slm:000243780 |
| formula | C65H104O6 |
| global charge | 0 |
| mol weight | 981.541 |
| InChIKey | PJYJZWIPWZNYTE-HRTSCYACSA-N |
| InChI | InChI=1S/C65H104O6/c1-4-7-10-13-16-19-22-25-27-29-31-32-34-36-38-41-43-46-49-52-55-58-64(67)70-61-62(71-65(68)59-56-53-50-47-44-39-24-21-18-15-12-9-6-3)60-69-63(66)57-54-51-48-45-42-40-37-35-33-30-28-26-23-20-17-14-11-8-5-2/h12,15-17,19-21,24-28,31-33,35-36,38,40,42,48,51,62H,4-11,13-14,18,22-23,29-30,34,37,39,41,43-47,49-50,52-61H2,1-3H3/b15-12-,19-16-,20-17-,24-21-,27-25-,28-26-,32-31-,35-33-,38-36-,42-40-,51-48-/t62-/m0/s1 |
| SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)O[C@@H](COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C65H104O6/c1-4-7-10-13-16-19-22-25-27-29-31-32-34-36-38-41-43-46-49-52-55-58-64(67)70-61-62(71-65(68)59-56-53-50-47-44-39-24-21-18-15-12-9-6-3)60-69-63(66)57-54-51-48-45-42-40-37-35-33-30-28-26-23-20-17-14-11-8-5-2/h12,15-17,19-21,24-28,31-33,35-36,38,40,42,48,51,62H,4-11,13-14,18,22-23,29-30,34,37,39,41,43-47,49-50,52-61H2,1-3H3/b15-12-,19-16-,20-17-,24-21-,27-25-,28-26-,32-31-,35-33-,38-36-,42-40-,51-48-/t62-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:29]/[CH:31]=[CH:32]\[CH2:34]/[CH:36]=[CH:38]\[CH2:41][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][C:64](=[O:67])[O:70][CH2:61][C@H:62]([CH2:60][O:69][C:63]([CH2:57][CH2:54]/[CH:51]=[CH:48]\[CH2:45]/[CH:42]=[CH:40]\[CH2:37]/[CH:35]=[CH:33]\[CH2:30]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66])[O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:39]/[CH:24]=[CH:21]\[CH2:18]/[CH:15]=[CH:12]\[CH2:9][CH2:6][CH3:3])=[O:68] |
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