| Properties | Image |
|---|
| MNX_ID | MNXM314584 |
 |
| reference | slm:000303909 |
| formula | C77H136O6 |
| global charge | 0 |
| mol weight | 1157.929 |
| InChIKey | RMTLTZAMTMVZAP-SWRIKINUSA-N |
| InChI | InChI=1S/C77H136O6/c1-4-7-10-13-16-19-22-25-28-31-33-35-36-37-38-39-40-42-44-47-50-53-56-59-62-65-68-71-77(80)83-74(72-81-75(78)69-66-63-60-57-54-51-48-45-30-27-24-21-18-15-12-9-6-3)73-82-76(79)70-67-64-61-58-55-52-49-46-43-41-34-32-29-26-23-20-17-14-11-8-5-2/h8,11,17-18,20-21,26-27,29-30,34,41,46,49,74H,4-7,9-10,12-16,19,22-25,28,31-33,35-40,42-45,47-48,50-73H2,1-3H3/b11-8-,20-17-,21-18-,29-26-,30-27-,41-34-,49-46-/t74-/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C77H136O6/c1-4-7-10-13-16-19-22-25-28-31-33-35-36-37-38-39-40-42-44-47-50-53-56-59-62-65-68-71-77(80)83-74(72-81-75(78)69-66-63-60-57-54-51-48-45-30-27-24-21-18-15-12-9-6-3)73-82-76(79)70-67-64-61-58-55-52-49-46-43-41-34-32-29-26-23-20-17-14-11-8-5-2/h8,11,17-18,20-21,26-27,29-30,34,41,46,49,74H,4-7,9-10,12-16,19,22-25,28,31-33,35-40,42-45,47-48,50-73H2,1-3H3/b11-8-,20-17-,21-18-,29-26-,30-27-,41-34-,49-46-/t74-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH2:33][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:42][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][CH2:62][CH2:65][CH2:68][CH2:71][C:77](=[O:80])[O:83][C@@H:74]([CH2:72][O:81][C:75]([CH2:69][CH2:66][CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:78])[CH2:73][O:82][C:76]([CH2:70][CH2:67][CH2:64][CH2:61][CH2:58][CH2:55][CH2:52]/[CH:49]=[CH:46]\[CH2:43]/[CH:41]=[CH:34]\[CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:79] |
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