| Properties | Image |
|---|
| MNX_ID | MNXM213615 |
 |
| reference | slm:000224186 |
| formula | C62H112O6 |
| global charge | 0 |
| mol weight | 953.572 |
| InChIKey | BLEOVIJLOAAKIF-BKIJXJJQSA-N |
| InChI | InChI=1S/C62H112O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-31-33-37-41-45-49-53-60(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)55-51-47-43-38-34-32-29-20-18-16-14-12-10-8-6-2/h14,16,19-21,29,34,38,58-59H,5-13,15,17-18,22-28,30-33,35-37,39-57H2,1-4H3/b16-14-,21-19-,29-20-,38-34-/t59-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C62H112O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-31-33-37-41-45-49-53-60(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)55-51-47-43-38-34-32-29-20-18-16-14-12-10-8-6-2/h14,16,19-21,29,34,38,58-59H,5-13,15,17-18,22-28,30-33,35-37,39-57H2,1-4H3/b16-14-,21-19-,29-20-,38-34-/t59-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17]/[CH:19]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:31][CH2:33][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][CH2:47][CH2:43]/[CH:38]=[CH:34]\[CH2:32]/[CH:29]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:65] |
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