| Properties | Image |
|---|
| MNX_ID | MNXM352542 |
 |
| reference | slm:000281402 |
| formula | C69H124O6 |
| global charge | 0 |
| mol weight | 1049.745 |
| InChIKey | PWMIOUCHDDBXNP-YPXIZVSFSA-N |
| InChI | InChI=1S/C69H124O6/c1-4-7-10-13-16-19-21-23-25-27-29-31-32-33-34-35-36-38-40-42-44-46-48-51-54-57-60-63-69(72)75-66(64-73-67(70)61-58-55-52-49-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-45-43-41-39-37-30-28-26-24-22-20-17-14-11-8-5-2/h17,20,24,26,30,37,41,43,47,50,66H,4-16,18-19,21-23,25,27-29,31-36,38-40,42,44-46,48-49,51-65H2,1-3H3/b20-17-,26-24-,37-30-,43-41-,50-47-/t66-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H124O6/c1-4-7-10-13-16-19-21-23-25-27-29-31-32-33-34-35-36-38-40-42-44-46-48-51-54-57-60-63-69(72)75-66(64-73-67(70)61-58-55-52-49-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-45-43-41-39-37-30-28-26-24-22-20-17-14-11-8-5-2/h17,20,24,26,30,37,41,43,47,50,66H,4-16,18-19,21-23,25,27-29,31-36,38-40,42,44-46,48-49,51-65H2,1-3H3/b20-17-,26-24-,37-30-,43-41-,50-47-/t66-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][CH2:63][C:69](=[O:72])[O:75][C@H:66]([CH2:64][O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:70])[CH2:65][O:74][C:68]([CH2:62][CH2:59][CH2:56][CH2:53]/[CH:50]=[CH:47]\[CH2:45]/[CH:43]=[CH:41]\[CH2:39]/[CH:37]=[CH:30]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:71] |
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