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Estetrol - 97%, high purity , Estrogen receptor agonist, CAS No.15183-37-6, Estrogen receptor agonist

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Estetrol - 97%, high purity , Estrogen receptor agonist, CAS No.15183-37-6, Estrogen receptor agonist

Moligand™

≥97%

CAS#: 15183-37-6
Formula: C₁₈H₂₄O₄
Molecular Weight: 304.38
PubChem CID: 27125

Item Number

E336724

Grouped product items
SKU	Size	Availability	Price
E336724-1mg	1mg	In stock	$157.90
E336724-5mg	5mg	In stock	$711.90
E336724-10mg	10mg	In stock	$1,279.90
E336724-25mg	25mg	In stock	$2,879.90
E336724-50mg	50mg	In stock	$5,183.90

a metabolite of Estradiol

Basic Description

Synonyms	estra-1,3,5(10)-triene-3,15alpha,16alpha,17beta-tetrol \| Drovelis (EMA); ; estetrol monohydrate + drospirenone \| ESTETROL [WHO-DD] \| (14beta,15alpha,16alpha,17alpha)-Estra-1,3,5(10)-Triene-3,15,16,17-Tetrol \| GTPL11591 \| WHO 10439 \| AT27982 \| CHEBI:14277
Specifications & Purity	Moligand™, ≥97%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads
Grade	Moligand™
Action Type	AGONIST
Mechanism of action	Estrogen receptor agonist
Product Description	A metabolite of Estradiol that is an estrogenic steroid synthesized exclusively by the fetal liver during human pregnancy and reaches the maternal circulation through the placenta.

Product Properties

ALogP	1.5

Associated Targets(Human)

ESR1 Tclin Estrogen receptor (2 Activities)

Discover Target: ESR1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ESR2 Tclin Estrogen receptor beta (2 Activities)

Discover Target: ESR2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)

Discover Target: ESR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ESR2 Tclin Estrogen receptor beta (9272 Activities)

Discover Target: ESR2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	(8R,9S,13S,14S,15R,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,15,16,17-tetrol
INCHI	InChI=1S/C18H24O4/c1-18-7-6-12-11-5-3-10(19)8-9(11)2-4-13(12)14(18)15(20)16(21)17(18)22/h3,5,8,12-17,19-22H,2,4,6-7H2,1H3/t12-,13-,14-,15-,16-,17+,18+/m1/s1
InChi Key	AJIPIJNNOJSSQC-NYLIRDPKSA-N
Canonical SMILES	CC12CCC3C(C1C(C(C2O)O)O)CCC4=C3C=CC(=C4)O
Isomeric SMILES	C[C@]12CC[C@H]3[C@H]([C@@H]1[C@H]([C@H]([C@@H]2O)O)O)CCC4=C3C=CC(=C4)O
PubChem CID	27125
Molecular Weight	304.38

Database links

CAS Registry No.	15183-37-6
PubChem CID	27125
ChEMBL Ligand	CHEMBL1230314
DrugBank Ligand	DB12235
BindingDB Ligand	158505
RCSB PDB Ligand	4OH

Certificates

Certificate of Analysis(COA)

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Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot Number	Certificate Type	Date	Item
L2214663	Certificate of Analysis	Dec 08, 2022	E336724
L2214965	Certificate of Analysis	Dec 08, 2022	E336724
L2215307	Certificate of Analysis	Dec 08, 2022	E336724
L2215308	Certificate of Analysis	Dec 08, 2022	E336724
L2215312	Certificate of Analysis	Dec 08, 2022	E336724

Chemical and Physical Properties

Solubility	Soluble in methanol, and acetone.
Refractive Index	n20D1.65 (Predicted)
Boil Point(°C)	491.94° C at 760 mmHg (Predicted)
Melt Point(°C)	233-236° C

Safety and Hazards(GHS)

Pictogram(s)	GHS08
Signal	Danger
Hazard Statements	H351:Suspected of causing cancer H360:May damage fertility or the unborn child H362:May cause harm to breast-fed children
Precautionary Statements	P280:Wear protective gloves/protective clothing/eye protection/face protection. P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P260:Do not breathe dust/fume/gas/mist/vapors/spray. P270:Do not eat, drink or smoke when using this product. P263:Avoid contact during pregnancy/while nursing. P203:Obtain, read and follow all safety instructions before use. P318:if exposed or concerned, get medical advice.

References

1. Coelingh Bennink HJ, Holinka CF, Diczfalusy E. (2008) Estetrol review: profile and potential clinical applications.. Climacteric, 11 Suppl 1 (13): (47-58). [PMID:18464023] [10.1021/op500134e]
2. Visser M, Foidart JM, Coelingh Bennink HJ. (2008) In vitro effects of estetrol on receptor binding, drug targets and human liver cell metabolism.. Climacteric, 11 Suppl 1 (13): (64-8). [PMID:18464025] [10.1021/op500134e]
3. P K. (2021) Estetrol and the possibilities of its clinical use.. Ceska Gynekol, 86 (3): (217-221). [PMID:34167315] [10.1021/op500134e]

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