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ChEBI
> Main
CHEBI:43355 - indoxyl sulfate
Main
ChEBI Ontology
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ChEBI Name
indoxyl sulfate
ChEBI ID
CHEBI:43355
Definition
An aryl sulfate that is indoxyl in which the hydroxyl hydrogen is substituted by a sulfo group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C8H7NO4S
Net Charge
0
Average Mass
213.21000
Monoisotopic Mass
213.00958
InChI
InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)
InChIKey
BXFFHSIDQOFMLE-UHFFFAOYSA-N
SMILES
OS(=O)(=O)Oc1c[nH]c2ccccc12
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
indoxyl sulfate (
CHEBI:43355
)
has functional parent
indoxyl (
CHEBI:17840
)
indoxyl sulfate (
CHEBI:43355
)
has role
human metabolite (
CHEBI:77746
)
indoxyl sulfate (
CHEBI:43355
)
is a
aryl sulfate (
CHEBI:37919
)
indoxyl sulfate (
CHEBI:43355
)
is a
indoles (
CHEBI:24828
)
indoxyl sulfate (
CHEBI:43355
)
is conjugate acid of
indoxyl sulfate(1−) (
CHEBI:144643
)
Incoming
indoxyl sulfate(1−) (
CHEBI:144643
)
is conjugate base of
indoxyl sulfate (
CHEBI:43355
)
IUPAC Name
1
H
-indol-3-yl hydrogen sulfate
Synonyms
Sources
3-indolyl hydrogen sulfate
ChEBI
3-indolyl sulfate
ChEBI
3-Indoxyl sulfate
ChemIDplus
3-Indoxylsulfuric acid
ChemIDplus
Indican
ChemIDplus
indol-3-yl hydrogen sulfate
ChEBI
Indol-3-yl sulfate
HMDB
indol-3-yl sulphate
HMDB
Indoxyl sulfic acid
HMDB
indoxyl sulphate
ChEBI
indoxyl-3-sulphate
ChEBI
Indoxylsulfuric acid
ChemIDplus
Manual Xrefs
Databases
HMDB0000682
HMDB
IOS
PDBeChem
View more database links
Registry Numbers
Types
Sources
188887
Reaxys Registry Number
Reaxys
487-94-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
17190852
PubMed citation
Europe PMC
22056374
PubMed citation
Europe PMC
22200421
PubMed citation
Europe PMC
22200422
PubMed citation
Europe PMC
22200425
PubMed citation
Europe PMC
22200426
PubMed citation
Europe PMC
22213462
PubMed citation
Europe PMC
22231736
PubMed citation
Europe PMC
22237753
PubMed citation
Europe PMC
22318422
PubMed citation
Europe PMC
22326498
PubMed citation
Europe PMC
22389425
PubMed citation
Europe PMC
22447217
PubMed citation
Europe PMC
22483453
PubMed citation
Europe PMC
22490877
PubMed citation
Europe PMC
22513409
PubMed citation
Europe PMC
Last Modified
20 April 2018