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loading...| Preferred Name |
benzenesulfonate |
|
| Synonyms |
phenylsulfonate Benzenesulfonic acid, ion(1-) benzenemonosulfonate besylate |
|
| Definitions |
The simplest of the class of benzenesulfonates, in which the benzene nucleus carries no other substituents. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_64457 |
|
| charge |
-1 |
|
| database_cross_reference |
Reaxys:1638927 CAS:3198-32-1 |
|
| definition |
The simplest of the class of benzenesulfonates, in which the benzene nucleus carries no other substituents. |
|
| formula |
C6H5O3S |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
phenylsulfonate Benzenesulfonic acid, ion(1-) benzenemonosulfonate besylate |
|
| id |
CHEBI:64457 |
|
| in_subset | ||
| inchi |
InChI=1S/C6H6O3S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H,7,8,9)/p-1 |
|
| inchikey |
SRSXLGNVWSONIS-UHFFFAOYSA-M |
|
| is conjugate base of | ||
| label |
benzenesulfonate |
|
| mass |
157.16700 |
|
| monoisotopicmass |
156.99649 |
|
| notation |
CHEBI:64457 |
|
| prefLabel |
benzenesulfonate |
|
| smiles |
[O-]S(=O)(=O)c1ccccc1 |
|
| subClassOf |
Create mapping
| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| http://purl.obolibrary.org/obo/CHEBI_64457 | PDRO | SAME_URI | |
| http://purl.obolibrary.org/obo/CHEBI_64457 | CHEBI | SAME_URI | |
| http://purl.obolibrary.org/obo/CHEBI_64457 | BERO | SAME_URI | |
| http://purl.obolibrary.org/obo/CHEBI_53348 | BIOMODELS | LOOM | |
| http://purl.obolibrary.org/obo/CHEBI_64457 | PDRO | LOOM | |
| http://purl.obolibrary.org/obo/CHEBI_64457 | CHEBI | LOOM | |
| http://purl.obolibrary.org/obo/CHEBI_64457 | BERO | LOOM | |
| http://purl.bioontology.org/ontology/RXNORM/1313278 | RXNORM | LOOM |