| Properties | Image |
|---|
| MNX_ID | MNXM326831 |
 |
| reference | slm:000226985 |
| formula | C63H104O6 |
| global charge | 0 |
| mol weight | 957.519 |
| InChIKey | RUGPGFQMUGAJAX-HKUWFVQNSA-N |
| InChI | InChI=1S/C63H104O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-36-39-42-45-48-51-54-57-63(66)69-60(58-67-61(64)55-52-49-46-43-40-37-34-26-23-20-17-14-11-8-5-2)59-68-62(65)56-53-50-47-44-41-38-35-27-24-21-18-15-12-9-6-3/h7,10,16-17,19-20,25-26,28,30-31,33-34,36,41-42,44-45,60H,4-6,8-9,11-15,18,21-24,27,29,32,35,37-40,43,46-59H2,1-3H3/b10-7-,19-16-,20-17-,28-25-,31-30-,34-26-,36-33-,44-41-,45-42-/t60-/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)CCCC/C=C\CCCCCCCCCCC)COC(=O)CCCCCCC/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H104O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-36-39-42-45-48-51-54-57-63(66)69-60(58-67-61(64)55-52-49-46-43-40-37-34-26-23-20-17-14-11-8-5-2)59-68-62(65)56-53-50-47-44-41-38-35-27-24-21-18-15-12-9-6-3/h7,10,16-17,19-20,25-26,28,30-31,33-34,36,41-42,44-45,60H,4-6,8-9,11-15,18,21-24,27,29,32,35,37-40,43,46-59H2,1-3H3/b10-7-,19-16-,20-17-,28-25-,31-30-,34-26-,36-33-,44-41-,45-42-/t60-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:36]\[CH2:39]/[CH:42]=[CH:45]\[CH2:48][CH2:51][CH2:54][CH2:57][C:63](=[O:66])[O:69][C@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37]/[CH:34]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:64])[CH2:59][O:68][C:62]([CH2:56][CH2:53][CH2:50][CH2:47]/[CH:44]=[CH:41]\[CH2:38][CH2:35][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:65] |
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