Grundinformationen
- Standard-SMILES
Cc1cc(=O)oc2cc(OS(=O)(=O)O)ccc12- InChIKey
FUYLLJCBCKRIAL-UHFFFAOYSA-N- Summenformel
- C10H8O6S
- Durchschnittliche Molmasse
- 256,23 g/mol
- Monoisotopische Masse
- 256,00415898
Überblick
4-methylumbelliferone sulfate is a member of the class of coumarins that is umbelliferone sulfate which carries a methyl group at position 4. It is a metabolite of 4-methylumbelliferone. It has a role as a human xenobiotic metabolite. It is a member of coumarins and an aryl sulfate. It is functionally related to an umbelliferone sulfate and a 4-methylumbelliferone. It is a conjugate acid of a 4-methylumbelliferone sulfate(1-).
Namen und Bezeichner
- Bevorzugter Name
- 4-Methylumbelliferyl sulfate
- IUPAC
- (4-methyl-2-oxochromen-7-yl) hydrogen sulfate
- Englischer Name
- 4-Methylumbelliferone sulfate
- Summenformel
- C10H8O6S
- Molmasse
- 256.23
Namen und Synonyme
4-Methylumbelliferone sulfate25892-63-14-methylumbelliferyl sulfateHymecromone sulfate(4-methyl-2-oxochromen-7-yl) hydrogen sulfateDTXSID60864564CHEBI:1905(4-methyl-2-oxo-chromen-7-yl) hydrogen sulfateRefChem:99968DTXCID701977144-Methyl-2-oxo-2h-chromen-7-yl hydrogen sulfate2H-1-Benzopyran-2-one, 4-methyl-7-(sulfooxy)-
Weitere Namen anzeigen
4-METHYLUMBELLIFERYLSULPHATE7-Hydroxy-4-methyl-2H-1-benzopyran-2-one 7-sulfate4-Methyl-2-oxo-2H-1-benzopyran-7-ylhydrogen sulfate4-METHYL-7-(SULFOOXY)-2H-1-BENZOPYRAN-2-ONE（WS201681）Sulfuric acid hydrogen 4-methyl-2-oxo-2H-1-benzopyran-7-yl ester
4-methyl-2-oxo-2H-1-benzopyran-7-yl hydrogen sulfate(4-Methyl-2-Oxidanylidene-Chromen-7-Yl) Hydrogen Sulfatehymecromone 7-sulfateAC1Q6XJIAC1L38AP4-methyl-7-(sulfooxy)-2H-1-Benzopyran-2-one7-sulfooxy-4-methylcoumarinSCHEMBL25184
Datenbank-Bezeichner
- CAS
25892-63-1- PubChem CID
- 84843
- DTXSID
DTXSID60864564- ChEMBL
CHEMBL2074784- ChEBI
CHEBI:1905- Nikkaji
- J387.587C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,3
- Polarare Oberfläche (TPSA)
- 98,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 17
- Formalladung
- 0
- Komplexität
- 446
Chemie und Industrie
Anbieter6 Anbieter
河南伊诺凯新材料有限公司15670530983 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
东阳市求索医药科技有限公司17502510579 · [email protected]
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
Hefei Hirisun Pharmatech Co., Ltd+8615056975894 · [email protected]
Zugehörige Reaktionen
0
Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.
Verknüpfte Notizen
Wird geladen…