| Properties | Image |
MNX_ID | MNXM357908 |
 |
reference | slm:000249136 |
formula | C64H122O6 |
global charge | 0 |
mol weight | 987.674 |
InChIKey | VYPIWWHQRCUEEU-CMPXIALDSA-N |
InChI | InChI=1S/C64H122O6/c1-4-7-10-13-16-19-22-25-27-29-31-32-33-35-37-40-42-45-48-51-54-57-63(66)69-60-61(70-64(67)58-55-52-49-46-43-38-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-39-36-34-30-28-26-23-20-17-14-11-8-5-2/h43,46,61H,4-42,44-45,47-60H2,1-3H3/b46-43-/t61-/m1/s1 |
SMILES | CCCCCCCCC/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C64H122O6/c1-4-7-10-13-16-19-22-25-27-29-31-32-33-35-37-40-42-45-48-51-54-57-63(66)69-60-61(70-64(67)58-55-52-49-46-43-38-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-39-36-34-30-28-26-23-20-17-14-11-8-5-2/h43,46,61H,4-42,44-45,47-60H2,1-3H3/b46-43-/t61-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:29][CH2:31][CH2:32][CH2:33][CH2:35][CH2:37][CH2:40][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][C:63](=[O:66])[O:69][CH2:60][C@@H:61]([CH2:59][O:68][C:62]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:39][CH2:36][CH2:34][CH2:30][CH2:28][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:65])[O:70][C:64]([CH2:58][CH2:55][CH2:52][CH2:49]/[CH:46]=[CH:43]\[CH2:38][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:67] |
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