3-hydroxyestra-1,3,5(10)-trien-17-one hydrogen sulphate structure
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Common Name | 3-hydroxyestra-1,3,5(10)-trien-17-one hydrogen sulphate | ||
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| CAS Number | 481-97-0 | Molecular Weight | 349.42100 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C18H21O5S- | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Use of 3-hydroxyestra-1,3,5(10)-trien-17-one hydrogen sulphateEstrone sulfate is an endogenous metabolite present in Blood that can be used for the research of X-Linked Ichthyosis and Obesity[1][2][3]. |
| Name | estrone 3-sulfate |
|---|---|
| Synonym | More Synonyms |
| Description | Estrone sulfate is an endogenous metabolite present in Blood that can be used for the research of X-Linked Ichthyosis and Obesity[1][2][3]. |
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| Related Catalog | |
| Target |
Human Endogenous Metabolite |
| In Vitro | Endogenous metabolites is defined as those that are annotated by Kyoto Encyclopedia of Genes and Genomes as substrates or products of the ~1900 metabolic enzymes encoded in our genome. It is clear in the body of literature that there are documented toxic properties for many of these metabolites[1]. |
| References |
| Molecular Formula | C18H21O5S- |
|---|---|
| Molecular Weight | 349.42100 |
| Exact Mass | 349.11100 |
| PSA | 91.88000 |
| LogP | 4.03160 |
| InChIKey | JKKFKPJIXZFSSB-CBZIJGRNSA-N |
| SMILES | CC12CCC3c4ccc(OS(=O)(=O)O)cc4CCC3C1CCC2=O |
| Storage condition | -20°C |
| Precursor 0 | |
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| DownStream 1 | |
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Name: TP_TRANSPORTER: uptake in BCRP-expressing LLC-PK1 cells
Source: ChEMBL
Target: Broad substrate specificity ATP-binding cassette transporter ABCG2
External Id: CHEMBL2075585
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Name: Apparent permeability from apical to basolateral side of vector transfected human Cac...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3539198
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Name: Apparent permeability from basolateral to apical side of vector transfected human Cac...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3539199
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Name: Inhibition of VGLUT-mediated [3H]-L-Glu uptake into synaptic vesicles in rat brain
Source: ChEMBL
Target: N/A
External Id: CHEMBL3119491
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Name: TP_TRANSPORTER: cell accumulation in OATP2-expressing HEK293 cells
Source: ChEMBL
Target: Solute carrier organic anion transporter family member 1B1
External Id: CHEMBL2076471
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Name: TP_TRANSPORTER: uptake (pH 7.4) of Estrone-3-sulfate at a concentration of 5.43 nM in...
Source: ChEMBL
Target: Solute carrier organic anion transporter family member 2B1
External Id: CHEMBL2077200
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Name: Inhibition of VGLUT in rat brain assessed as [3H]-L-Glu uptake into synaptic vesicles...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3119492
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Name: TP_TRANSPORTER: uptake in OATP-D-expressing HEK293 cells
Source: ChEMBL
Target: Solute carrier organic anion transporter family member 3A1
External Id: CHEMBL2076477
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Name: Drug uptake in mouse Astrocyte cells expressing OATPIC4/5/6 at 100 uM incubated for 3...
Source: ChEMBL
Target: N/A
External Id: CHEMBL5392421
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Name: TP_TRANSPORTER: inhibition of Ochratoxin A uptake (OTA: 1 uM, E1S: 100uM) in Xenopus ...
Source: ChEMBL
Target: Solute carrier organic anion transporter family member 1A1
External Id: CHEMBL2076391
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| estrone-3-sulfate |