| Properties | Image |
|---|
| MNX_ID | MNXM1198005 |
 |
| reference | envipathM:...fd9915aa1fec |
| formula | C37H64O8 |
| global charge | 0 |
| mol weight | 636.911 |
| InChIKey | MWTPIVQXHQZOSZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O8/c1-3-5-6-19-25-33(40)37-34(45-37)26-20-15-13-17-21-27-35(41)43-30-32(29-38)44-36(42)28-22-16-12-10-8-7-9-11-14-18-24-31(39)23-4-2/h9,11,18,24,31-32,34,37-39H,3-8,10,12-17,19-23,25-30H2,1-2H3 |
| SMILES | CCCCCCC(=O)C1OC1CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O8/c1-3-5-6-19-25-33(40)37-34(45-37)26-20-15-13-17-21-27-35(41)43-30-32(29-38)44-36(42)28-22-16-12-10-8-7-9-11-14-18-24-31(39)23-4-2/h9,11,18,24,31-32,34,37-39H,3-8,10,12-17,19-23,25-30H2,1-2H3/b11-9?,24-18?/t31?,32?,34?,37? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH2:19][CH2:25][C:33]([CH:37]1[CH:34]([CH2:26][CH2:20][CH2:15][CH2:13][CH2:17][CH2:21][CH2:27][C:35](=[O:41])[O:43][CH2:30][CH:32]([CH2:29][OH:38])[O:44][C:36]([CH2:28][CH2:22][CH2:16][CH2:12][CH2:10][CH2:8][CH2:7][CH:9]=[CH:11][CH2:14][CH:18]=[CH:24][CH:31]([CH2:23][CH2:4][CH3:2])[OH:39])=[O:42])[O:45]1)=[O:40] |
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