| Properties | Image |
MNX_ID | MNXM360755 |
 |
reference | slm:000196687 |
formula | C59H112O6 |
global charge | 0 |
mol weight | 917.539 |
InChIKey | PLCAFASJPYFTBQ-VWUQNWLNSA-N |
InChI | InChI=1S/C59H112O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-31-33-35-39-44-48-52-59(62)65-56(54-64-58(61)51-47-43-40-36-37-41-45-49-55(3)4)53-63-57(60)50-46-42-38-34-32-30-20-18-16-14-12-10-8-6-2/h19,21,55-56H,5-18,20,22-54H2,1-4H3/b21-19-/t56-/m1/s1 |
SMILES | CCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCC(C)C |
MNX internals
InChI (mnx) | InChI=1/C59H112O6/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-31-33-35-39-44-48-52-59(62)65-56(54-64-58(61)51-47-43-40-36-37-41-45-49-55(3)4)53-63-57(60)50-46-42-38-34-32-30-20-18-16-14-12-10-8-6-2/h19,21,55-56H,5-18,20,22-54H2,1-4H3/b21-19-/t56-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17]/[CH:19]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:31][CH2:33][CH2:35][CH2:39][CH2:44][CH2:48][CH2:52][C:59](=[O:62])[O:65][C@H:56]([CH2:53][O:63][C:57]([CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:32][CH2:30][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:60])[CH2:54][O:64][C:58]([CH2:51][CH2:47][CH2:43][CH2:40][CH2:36][CH2:37][CH2:41][CH2:45][CH2:49][CH:55]([CH3:3])[CH3:4])=[O:61] |
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