| Properties | Image |
|---|
| MNX_ID | MNXM185150 |
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| reference | slm:000263245 |
| formula | C66H122O6 |
| global charge | 0 |
| mol weight | 1011.696 |
| InChIKey | LDQYVPAXJWOZRK-HAHAZFJISA-N |
| InChI | InChI=1S/C66H122O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-32-33-34-35-37-39-41-43-45-48-51-54-57-60-66(69)72-63(61-70-64(67)58-55-52-49-46-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-42-40-38-36-29-27-25-23-20-17-14-11-8-5-2/h17,20,25,27,36,38,63H,4-16,18-19,21-24,26,28-35,37,39-62H2,1-3H3/b20-17-,27-25-,38-36-/t63-/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C66H122O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-32-33-34-35-37-39-41-43-45-48-51-54-57-60-66(69)72-63(61-70-64(67)58-55-52-49-46-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-42-40-38-36-29-27-25-23-20-17-14-11-8-5-2/h17,20,25,27,36,38,63H,4-16,18-19,21-24,26,28-35,37,39-62H2,1-3H3/b20-17-,27-25-,38-36-/t63-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][C:66](=[O:69])[O:72][C@@H:63]([CH2:61][O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:67])[CH2:62][O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:42][CH2:40]/[CH:38]=[CH:36]\[CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:68] |
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