| Properties | Image |
|---|
| MNX_ID | MNXM336696 |
 |
| reference | slm:000248126 |
| formula | C65H110O6 |
| global charge | 0 |
| mol weight | 987.589 |
| InChIKey | CZUVGVWFJCRDLP-LJLVNKSISA-N |
| InChI | InChI=1S/C65H110O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-38-40-43-46-49-52-55-58-64(67)70-61-62(60-69-63(66)57-54-51-48-45-42-21-18-15-12-9-6-3)71-65(68)59-56-53-50-47-44-41-39-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h8,11,15,17-18,20,24-27,31,33,37,39,44,47,62H,4-7,9-10,12-14,16,19,21-23,28-30,32,34-36,38,40-43,45-46,48-61H2,1-3H3/b11-8-,18-15-,20-17-,26-24-,27-25-,33-31-,39-37-,47-44-/t62-/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)CCCCCCC/C=C\CCCC)COC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C65H110O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-38-40-43-46-49-52-55-58-64(67)70-61-62(60-69-63(66)57-54-51-48-45-42-21-18-15-12-9-6-3)71-65(68)59-56-53-50-47-44-41-39-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h8,11,15,17-18,20,24-27,31,33,37,39,44,47,62H,4-7,9-10,12-14,16,19,21-23,28-30,32,34-36,38,40-43,45-46,48-61H2,1-3H3/b11-8-,18-15-,20-17-,26-24-,27-25-,33-31-,39-37-,47-44-/t62-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:24]=[CH:26]\[CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][C:64](=[O:67])[O:70][CH2:61][C@@H:62]([CH2:60][O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:66])[O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50]/[CH:47]=[CH:44]\[CH2:41]/[CH:39]=[CH:37]\[CH2:35]/[CH:33]=[CH:31]\[CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:68] |
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