| Properties | Image |
|---|
| MNX_ID | MNXM39095 |
 |
| reference | chebi:31142 |
| formula | C14H15NO7 |
| global charge | 0 |
| mol weight | 309.274 |
| InChIKey | GVGWJJOWWDRYOF-DZDPUUJWSA-N |
| InChI | InChI=1S/C14H15NO7/c16-10-8-4-1-6-7(22-3-21-6)2-5(4)14(20)15-9(8)11(17)13(19)12(10)18/h1-2,8-13,16-19H,3H2,(H,15,20)/t8-,9-,10-,11+,12+,13+/m1/s1 |
| SMILES | O=C1N[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@@H]2C2=C1C=C1OCOC1=C2 |
MNX internals
| InChI (mnx) | InChI=1/C14H15NO7/c16-10-8-4-1-6-7(22-3-21-6)2-5(4)14(20)15-9(8)11(17)13(19)12(10)18/h1-2,8-13,16-19H,3H2,(H,15,20)/t8-,9-,10-,11+,12+,13+/m1/s1 |
 |
| SMILES (mnx) | [CH:1]1=[C:4]2[C:5](=[CH:2][C:7]3=[C:6]1[O:21][CH2:3][O:22]3)[C:14]([OH:20])=[N:15][C@@H:9]1[C@@H:8]2[C@@H:10]([OH:16])[C@H:12]([OH:18])[C@@H:13]([OH:19])[C@H:11]1[OH:17] |
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