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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:37510 - anthralin
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ChEBI Name
anthralin
ChEBI ID
CHEBI:37510
Definition
An anthracene compound derived by the substitution of -OH groups for hydrogen at C-1 and C-8, and with an oxo group at C-9.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C14H10O3
Net Charge
0
Average Mass
226.22740
Monoisotopic Mass
226.06299
InChI
InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-6,15-16H,7H2
InChIKey
NUZWLKWWNNJHPT-UHFFFAOYSA-N
SMILES
Oc1cccc2Cc3cccc(O)c3C(=O)c12
Roles Classification
Application
(s):
antipsoriatic
A drug used to treat psoriasis.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
anthralin (
CHEBI:37510
)
has functional parent
anthrone (
CHEBI:33835
)
anthralin (
CHEBI:37510
)
has role
antipsoriatic (
CHEBI:50748
)
anthralin (
CHEBI:37510
)
is a
anthracenes (
CHEBI:46955
)
anthralin (
CHEBI:37510
)
is tautomer of
anthracene-1,8,9-triol (
CHEBI:2756
)
Incoming
chrysophanol-9-anthrone (
CHEBI:3686
)
has functional parent
anthralin (
CHEBI:37510
)
anthracene-1,8,9-triol (
CHEBI:2756
)
is tautomer of
anthralin (
CHEBI:37510
)
IUPAC Name
1,8-dihydroxyanthracen-9(10
H
)-one
Synonyms
Sources
1,8-dihydroxy-9(10
H
)-anthracenone
NIST Chemistry WebBook
1,8-dihydroxy-9-anthrone
NIST Chemistry WebBook
1,8-dihydroxyanthrone
ChemIDplus
Anthralin
KEGG COMPOUND
dithranol
ChemIDplus
Manual Xrefs
Databases
226
DrugCentral
C06831
KEGG COMPOUND
D00233
KEGG DRUG
Dithranol
Wikipedia
LSM-6530
LINCS
View more database links
Registry Numbers
Types
Sources
1143-38-0
CAS Registry Number
NIST Chemistry WebBook
1143-38-0
CAS Registry Number
ChemIDplus
2054360
Beilstein Registry Number
ChemIDplus
2054360
Reaxys Registry Number
Reaxys
Citations
Types
Sources
1640019
PubMed citation
Europe PMC
22335232
PubMed citation
Europe PMC
22370944
PubMed citation
Europe PMC
22931516
PubMed citation
Europe PMC
23079823
PubMed citation
Europe PMC
23088318
PubMed citation
Europe PMC
23488784
PubMed citation
Europe PMC
23594093
PubMed citation
Europe PMC
Last Modified
22 February 2017