| Properties | Image |
|---|
| MNX_ID | MNXM276618 |
 |
| reference | slm:000148631 |
| formula | C54H94O6 |
| global charge | 0 |
| mol weight | 839.34 |
| InChIKey | NIGZKAKHFJPKCR-IZWDLXJOSA-N |
| InChI | InChI=1S/C54H94O6/c1-4-7-10-13-16-19-21-23-24-25-26-27-28-29-30-31-33-36-38-41-44-47-53(56)59-50-51(60-54(57)48-45-42-39-34-18-15-12-9-6-3)49-58-52(55)46-43-40-37-35-32-22-20-17-14-11-8-5-2/h16,19,23-24,26-27,29-30,33,36,51H,4-15,17-18,20-22,25,28,31-32,34-35,37-50H2,1-3H3/b19-16-,24-23-,27-26-,30-29-,36-33-/t51-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H94O6/c1-4-7-10-13-16-19-21-23-24-25-26-27-28-29-30-31-33-36-38-41-44-47-53(56)59-50-51(60-54(57)48-45-42-39-34-18-15-12-9-6-3)49-58-52(55)46-43-40-37-35-32-22-20-17-14-11-8-5-2/h16,19,23-24,26-27,29-30,33,36,51H,4-15,17-18,20-22,25,28,31-32,34-35,37-50H2,1-3H3/b19-16-,24-23-,27-26-,30-29-,36-33-/t51-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31]/[CH:33]=[CH:36]\[CH2:38][CH2:41][CH2:44][CH2:47][C:53](=[O:56])[O:59][CH2:50][C@H:51]([CH2:49][O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:35][CH2:32][CH2:22][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:55])[O:60][C:54]([CH2:48][CH2:45][CH2:42][CH2:39][CH2:34][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:57] |
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