| Properties | Image |
|---|
| MNX_ID | MNXM356979 |
 |
| reference | slm:000213570 |
| formula | C61H110O6 |
| global charge | 0 |
| mol weight | 939.545 |
| InChIKey | QDCAVCOXXHYKHV-LPFGPRJYSA-N |
| InChI | InChI=1S/C61H110O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-33-37-41-45-49-53-60(63)66-56-58(67-61(64)54-50-46-42-38-34-30-31-35-39-43-47-51-57(3)4)55-65-59(62)52-48-44-40-36-32-28-26-24-22-20-18-16-14-12-10-8-6-2/h14,16,20,22,26,28,36,40,57-58H,5-13,15,17-19,21,23-25,27,29-35,37-39,41-56H2,1-4H3/b16-14-,22-20-,28-26-,40-36-/t58-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C61H110O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-33-37-41-45-49-53-60(63)66-56-58(67-61(64)54-50-46-42-38-34-30-31-35-39-43-47-51-57(3)4)55-65-59(62)52-48-44-40-36-32-28-26-24-22-20-18-16-14-12-10-8-6-2/h14,16,20,22,26,28,36,40,57-58H,5-13,15,17-19,21,23-25,27,29-35,37-39,41-56H2,1-4H3/b16-14-,22-20-,28-26-,40-36-/t58-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:33][CH2:37][CH2:41][CH2:45][CH2:49][CH2:53][C:60](=[O:63])[O:66][CH2:56][C@H:58]([CH2:55][O:65][C:59]([CH2:52][CH2:48][CH2:44]/[CH:40]=[CH:36]\[CH2:32]/[CH:28]=[CH:26]\[CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:62])[O:67][C:61]([CH2:54][CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:30][CH2:31][CH2:35][CH2:39][CH2:43][CH2:47][CH2:51][CH:57]([CH3:3])[CH3:4])=[O:64] |
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