| Properties | Image | Occurences in reactions |
MNX_ID | MNXM1525442 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C23H24O9 |
charge | 0 |
mass | 444.436 |
reference | hmdb:HMDB0303032 |
InChIKey | PATJZXBBUQEFOY-UHFFFAOYSA-N |
InChI | InChI=1S/C23H24O9/c1-29-20-11-15(3-7-18(20)25)5-9-22(27)31-13-17(24)14-32-23(28)10-6-16-4-8-19(26)21(12-16)30-2/h3-12,17,24-26H,13-14H2,1-2H3 |
SMILES | [CH3:1][O:29][c:20]1[cH:11][c:15]([CH:5]=[CH:9][C:22](=[O:27])[O:31][CH2:13][CH:17]([CH2:14][O:32][C:23]([CH:10]=[CH:6][c:16]2[cH:4][cH:8][c:19]([OH:26])[c:21]([O:30][CH3:2])[cH:12]2)=[O:28])[OH:24])[cH:3][cH:7][c:18]1[OH:25] |
|