| Properties | Image |
|---|
| MNX_ID | MNXM1173317 |
 |
| reference | envipathM:...17badb2674d3 |
| formula | C14H15NO5S |
| global charge | 0 |
| mol weight | 309.343 |
| InChIKey | KACLVJCAECUGNI-UHFFFAOYSA-N |
| InChI | InChI=1S/C14H15NO5S/c16-10-7-6-9-11(12(10)17)14(19)15(13(9)18)21(20)8-4-2-1-3-5-8/h6-8,16-17H,1-5H2 |
| SMILES | O=C1C2=CC=C(O)C(O)=C2C(=O)N1S(=O)C1CCCCC1 |
MNX internals
| InChI (mnx) | InChI=1/C14H15NO5S/c16-10-7-6-9-11(12(10)17)14(19)15(13(9)18)21(20)8-4-2-1-3-5-8/h6-8,16-17H,1-5H2/t21? |
 |
| SMILES (mnx) | [CH2:1]1[CH2:2][CH2:4][CH:8]([S:21]([N:15]2[C:13](=[O:18])[C:9]3=[C:11]([C:12]([OH:17])=[C:10]([OH:16])[CH:7]=[CH:6]3)[C:14]2=[O:19])=[O:20])[CH2:5][CH2:3]1 |
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