| Properties | Image |
|---|
| MNX_ID | MNXM1194465 |
 |
| reference | envipathM:...db1c85cc400e |
| formula | C37H64O8 |
| global charge | 0 |
| mol weight | 636.911 |
| InChIKey | BJCOBQMIEYKBKJ-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O8/c1-3-5-6-14-20-25-34-35(45-34)26-21-16-13-18-22-27-36(41)43-30-31(29-38)44-37(42)28-23-17-12-10-8-7-9-11-15-19-24-33(40)32(39)4-2/h9,11,19,24,29,31-35,39-40H,3-8,10,12-18,20-23,25-28,30H2,1-2H3 |
| SMILES | CCCCCCCC1OC1CCCCCCCC(=O)OCC(C=O)OC(=O)CCCCCCCC=CCC=CC(O)C(O)CC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O8/c1-3-5-6-14-20-25-34-35(45-34)26-21-16-13-18-22-27-36(41)43-30-31(29-38)44-37(42)28-23-17-12-10-8-7-9-11-15-19-24-33(40)32(39)4-2/h9,11,19,24,29,31-35,39-40H,3-8,10,12-18,20-23,25-28,30H2,1-2H3/b11-9?,24-19?/t31?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH2:14][CH2:20][CH2:25][CH:34]1[CH:35]([CH2:26][CH2:21][CH2:16][CH2:13][CH2:18][CH2:22][CH2:27][C:36](=[O:41])[O:43][CH2:30][CH:31]([CH:29]=[O:38])[O:44][C:37]([CH2:28][CH2:23][CH2:17][CH2:12][CH2:10][CH2:8][CH2:7][CH:9]=[CH:11][CH2:15][CH:19]=[CH:24][CH:33]([CH:32]([CH2:4][CH3:2])[OH:39])[OH:40])=[O:42])[O:45]1 |
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