| Properties | Image |
|---|
| MNX_ID | MNXM1191124 |
 |
| reference | envipathM:...f3c047c0c2e2 |
| formula | C32H41F17O7 |
| global charge | -2 |
| mol weight | 860.639 |
| InChIKey | GGIHDEAYOBZTOR-UHFFFAOYSA-L |
| InChI | InChI=1S/C32H43F17O7/c1-24(55,20(23(53)54)19-21(50)51)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-22(52)56-18-17-25(33,34)26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)31(45,46)32(47,48)49/h20,55H,2-19H2,1H3,(H,50,51)(H,53,54)/p-2 |
| SMILES | CC(O)(CCCCCCCCCCCCCCCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(CC(=O)[O-])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C32H43F17O7/c1-24(55,20(23(53)54)19-21(50)51)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-22(52)56-18-17-25(33,34)26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)31(45,46)32(47,48)49/h20,55H,2-19H2,1H3,(H,50,51)(H,53,54)/t20?,24? |
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| SMILES (mnx) | [CH3:1][C:24]([CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH2:2][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][C:22](=[O:52])[O:56][CH2:18][CH2:17][C:25]([C:26]([C:27]([C:28]([C:29]([C:30]([C:31]([C:32]([F:47])([F:48])[F:49])([F:45])[F:46])([F:43])[F:44])([F:41])[F:42])([F:39])[F:40])([F:37])[F:38])([F:35])[F:36])([F:33])[F:34])([CH:20]([CH2:19][C:21](=[O:50])[OH:51])[C:23](=[O:53])[OH:54])[OH:55] |
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