| Properties | Image |
MNX_ID | MNXM358611 |
 |
reference | slm:000257748 |
formula | C66H114O6 |
global charge | 0 |
mol weight | 1003.632 |
InChIKey | NZIFGLDJMBGDRB-KLVKFGQWSA-N |
InChI | InChI=1S/C66H114O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-36-39-41-44-47-50-53-56-59-65(68)71-62-63(72-66(69)60-57-54-51-48-45-42-37-27-24-21-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-40-38-35-31-29-26-23-20-17-14-11-8-5-2/h7,10,16,18-19,21,25,27-28,32-33,36-37,39,63H,4-6,8-9,11-15,17,20,22-24,26,29-31,34-35,38,40-62H2,1-3H3/b10-7-,19-16-,21-18-,28-25-,33-32-,37-27-,39-36-/t63-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC |
MNX internals
InChI (mnx) | InChI=1/C66H114O6/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-36-39-41-44-47-50-53-56-59-65(68)71-62-63(72-66(69)60-57-54-51-48-45-42-37-27-24-21-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-40-38-35-31-29-26-23-20-17-14-11-8-5-2/h7,10,16,18-19,21,25,27-28,32-33,36-37,39,63H,4-6,8-9,11-15,17,20,22-24,26,29-31,34-35,38,40-62H2,1-3H3/b10-7-,19-16-,21-18-,28-25-,33-32-,37-27-,39-36-/t63-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:32]=[CH:33]\[CH2:34]/[CH:36]=[CH:39]\[CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][C:65](=[O:68])[O:71][CH2:62][C@@H:63]([CH2:61][O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:38][CH2:35][CH2:31][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:67])[O:72][C:66]([CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42]/[CH:37]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:69] |
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