| Properties | Image |
|---|
| MNX_ID | MNXM296005 |
 |
| reference | slm:000214762 |
| formula | C62H100O6 |
| global charge | 0 |
| mol weight | 941.476 |
| InChIKey | CEKTUURZZUPJDM-KDCARCAMSA-N |
| InChI | InChI=1S/C62H100O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-41-45-49-53-60(63)66-56-59(57-67-61(64)54-50-46-42-39-35-36-40-44-48-52-58(3)4)68-62(65)55-51-47-43-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,13-16,19-22,25-28,31-34,43,47,58-59H,5-7,9,11-12,17-18,23-24,29-30,35-42,44-46,48-57H2,1-4H3/b10-8-,15-13-,16-14-,21-19-,22-20-,27-25-,28-26-,33-31-,34-32-,47-43-/t59-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O[C@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C62H100O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-41-45-49-53-60(63)66-56-59(57-67-61(64)54-50-46-42-39-35-36-40-44-48-52-58(3)4)68-62(65)55-51-47-43-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,13-16,19-22,25-28,31-34,43,47,58-59H,5-7,9,11-12,17-18,23-24,29-30,35-42,44-46,48-57H2,1-4H3/b10-8-,15-13-,16-14-,21-19-,22-20-,27-25-,28-26-,33-31-,34-32-,47-43-/t59-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:23]/[CH:25]=[CH:27]\[CH2:29]/[CH:31]=[CH:33]\[CH2:37][CH2:41][CH2:45][CH2:49][CH2:53][C:60](=[O:63])[O:66][CH2:56][C@H:59]([CH2:57][O:67][C:61]([CH2:54][CH2:50][CH2:46][CH2:42][CH2:39][CH2:35][CH2:36][CH2:40][CH2:44][CH2:48][CH2:52][CH:58]([CH3:3])[CH3:4])=[O:64])[O:68][C:62]([CH2:55][CH2:51]/[CH:47]=[CH:43]\[CH2:38]/[CH:34]=[CH:32]\[CH2:30]/[CH:28]=[CH:26]\[CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])=[O:65] |
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