| Properties | Image |
|---|
| MNX_ID | MNXM43085 |
 |
| reference | keggD:D03018 |
| formula | C25H24FNO6 |
| global charge | 0 |
| mol weight | 453.466 |
| InChIKey | FUBBWDWIGBTUPQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C25H24FNO6/c1-4-32-25(31)24(30)27-18-11-14(2)23(15(3)12-18)33-19-9-10-21(28)20(13-19)22(29)16-5-7-17(26)8-6-16/h5-13,22,28-29H,4H2,1-3H3,(H,27,30) |
| SMILES | CCOC(=O)C(=O)NC1=CC(C)=C(OC2=CC=C(O)C(C(O)C3=CC=C(F)C=C3)=C2)C(C)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C25H24FNO6/c1-4-32-25(31)24(30)27-18-11-14(2)23(15(3)12-18)33-19-9-10-21(28)20(13-19)22(29)16-5-7-17(26)8-6-16/h5-13,22,28-29H,4H2,1-3H3,(H,27,30)/t22? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][O:32][C:25]([C:24](=[N:27][C:18]1=[CH:12][C:15]([CH3:3])=[C:23]([O:33][C:19]2=[CH:13][C:20]([CH:22]([C:16]3=[CH:6][CH:8]=[C:17]([F:26])[CH:7]=[CH:5]3)[OH:29])=[C:21]([OH:28])[CH:10]=[CH:9]2)[C:14]([CH3:2])=[CH:11]1)[OH:30])=[O:31] |
|