| Properties | Image |
|---|
| MNX_ID | MNXM32907 |
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| reference | chebi:60752 |
| formula | C38H66FNO9 |
| global charge | 0 |
| mol weight | 699.942 |
| InChIKey | FBUHIWMNUBFIJZ-ZORUMLJWSA-N |
| InChI | InChI=1S/C38H66FNO9/c1-2-3-4-5-6-7-8-9-10-11-14-17-20-31(42)34(44)30(27-48-38-37(47)36(46)35(45)32(26-41)49-38)40-33(43)21-18-15-12-13-16-19-28-22-24-29(39)25-23-28/h22-25,30-32,34-38,41-42,44-47H,2-21,26-27H2,1H3,(H,40,43)/t30-,31+,32+,34-,35-,36-,37+,38-/m0/s1 |
| SMILES | CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCC1=CC=C(F)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C38H66FNO9/c1-2-3-4-5-6-7-8-9-10-11-14-17-20-31(42)34(44)30(27-48-38-37(47)36(46)35(45)32(26-41)49-38)40-33(43)21-18-15-12-13-16-19-28-22-24-29(39)25-23-28/h22-25,30-32,34-38,41-42,44-47H,2-21,26-27H2,1H3,(H,40,43)/t30-,31+,32+,34-,35-,36-,37+,38-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:14][CH2:17][CH2:20][C@H:31]([C@H:34]([C@H:30]([CH2:27][O:48][C@@H:38]1[C@H:37]([OH:47])[C@@H:36]([OH:46])[C@@H:35]([OH:45])[C@@H:32]([CH2:26][OH:41])[O:49]1)[N:40]=[C:33]([CH2:21][CH2:18][CH2:15][CH2:12][CH2:13][CH2:16][CH2:19][C:28]1=[CH:23][CH:25]=[C:29]([F:39])[CH:24]=[CH:22]1)[OH:43])[OH:44])[OH:42] |
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