| Properties | Image |
|---|
| MNX_ID | MNXM350831 |
 |
| reference | slm:000201751 |
| formula | C61H96O6 |
| global charge | 0 |
| mol weight | 925.433 |
| InChIKey | PQRGUSRWJHDERQ-OCFCQMKPSA-N |
| InChI | InChI=1S/C61H96O6/c1-4-7-10-13-16-19-21-23-25-27-29-30-32-34-36-38-40-43-46-49-52-55-61(64)67-58(56-65-59(62)53-50-47-44-41-18-15-12-9-6-3)57-66-60(63)54-51-48-45-42-39-37-35-33-31-28-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,29-31,33-34,36-37,39-40,43,45,48,58H,4-6,8-9,11-15,18,21-22,27-28,32,35,38,41-42,44,46-47,49-57H2,1-3H3/b10-7-,19-16-,20-17-,25-23-,26-24-,30-29-,33-31-,36-34-,39-37-,43-40-,48-45-/t58-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C61H96O6/c1-4-7-10-13-16-19-21-23-25-27-29-30-32-34-36-38-40-43-46-49-52-55-61(64)67-58(56-65-59(62)53-50-47-44-41-18-15-12-9-6-3)57-66-60(63)54-51-48-45-42-39-37-35-33-31-28-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,29-31,33-34,36-37,39-40,43,45,48,58H,4-6,8-9,11-15,18,21-22,27-28,32,35,38,41-42,44,46-47,49-57H2,1-3H3/b10-7-,19-16-,20-17-,25-23-,26-24-,30-29-,33-31-,36-34-,39-37-,43-40-,48-45-/t58-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:30]\[CH2:32]/[CH:34]=[CH:36]\[CH2:38]/[CH:40]=[CH:43]\[CH2:46][CH2:49][CH2:52][CH2:55][C:61](=[O:64])[O:67][C@H:58]([CH2:56][O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:62])[CH2:57][O:66][C:60]([CH2:54][CH2:51]/[CH:48]=[CH:45]\[CH2:42]/[CH:39]=[CH:37]\[CH2:35]/[CH:33]=[CH:31]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:63] |
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