| Properties | Image |
|---|
| MNX_ID | MNXM317966 |
 |
| reference | slm:000240949 |
| formula | C64H112O6 |
| global charge | 0 |
| mol weight | 977.594 |
| InChIKey | MXLBETJBBKZPFS-GXSPKBQUSA-N |
| InChI | InChI=1S/C64H112O6/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-37-39-42-45-48-51-54-57-63(66)69-60-61(59-68-62(65)56-53-50-47-44-41-38-35-27-24-21-18-15-12-9-6-3)70-64(67)58-55-52-49-46-43-40-36-29-26-23-20-17-14-11-8-5-2/h16,18-19,21,25,27-28,31-32,34-35,37,61H,4-15,17,20,22-24,26,29-30,33,36,38-60H2,1-3H3/b19-16-,21-18-,28-25-,32-31-,35-27-,37-34-/t61-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C64H112O6/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-37-39-42-45-48-51-54-57-63(66)69-60-61(59-68-62(65)56-53-50-47-44-41-38-35-27-24-21-18-15-12-9-6-3)70-64(67)58-55-52-49-46-43-40-36-29-26-23-20-17-14-11-8-5-2/h16,18-19,21,25,27-28,31-32,34-35,37,61H,4-15,17,20,22-24,26,29-30,33,36,38-60H2,1-3H3/b19-16-,21-18-,28-25-,32-31-,35-27-,37-34-/t61-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33]/[CH:34]=[CH:37]\[CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][C:63](=[O:66])[O:69][CH2:60][C@H:61]([CH2:59][O:68][C:62]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38]/[CH:35]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:65])[O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:36][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:67] |
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