| Properties | Image | Occurences in reactions |
MNX_ID | MNXM165570 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 1 |
in models (compartimentalized) |
0 |
|
formula | C21H25NO11 |
charge | 0 |
mass | 467.14276 |
reference | sabiorkM:23769 |
InChIKey | KKDWIUJBUSOPGC-KPPVFQKOSA-N |
InChI | InChI=1S/C21H25NO11/c1-9-5-16(27)31-15-6-11(3-4-12(9)15)32-21(20(29)30)7-13(25)17(22-10(2)24)19(33-21)18(28)14(26)8-23/h3-6,13-14,17-19,23,25-26,28H,7-8H2,1-2H3,(H,22,24)(H,29,30)/t13-,14+,17+,18?,19+,21+/m0/s1 |
SMILES | CC(O)=N[C@@H]1[C@@H](O)C[C@](Oc2ccc3c(C)cc(=O)oc3c2)(C(=O)O)O[C@H]1C(O)[C@H](O)CO |
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