| PDB CCD ID: | 667 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C14 H15 N O5 S |
| InChI: | InChI=1S/C14H15NO5S/c15-21(17,18)20-9-6-7-11-10-4-2-1-3-5-12(10)14(16)19-13(11)8-9/h6-8H,1-5H2,(H2,15,17,18) |
| InChIKey: | DSLPMJSGSBLWRE-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.341 | N[S](=O)(=O)Oc1ccc2C3=C(CCCCC3)C(=O)Oc2c1 | | ACDLabs 10.04 | O=S(=O)(Oc1cc2OC(=O)C3=C(c2cc1)CCCCC3)N | | OpenEye OEToolkits 1.5.0 | c1cc2c(cc1OS(=O)(=O)N)OC(=O)C3=C2CCCCC3 |
|
| Name: | 6-OXO-8,9,10,11-TETRAHYDRO-7H-CYCLOHEPTA[C][1]BENZOPYRAN-3-O-SULFAMATE |
| ChEMBL: | CHEMBL286738 |
| DrugBank: | DB02292 |
| ZINC: | ZINC000001549366 |
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