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α-Estradiol - ≥98%, high purity , CAS No.57-91-0

Item Number
E194035
Grouped product items
SKUSizeAvailabilityPrice Qty
E194035-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$92.90
E194035-250mg
250mg
2
$97.90
E194035-1g
1g
3
$241.90
E194035-5g
5g
3
$756.90

Endogenous estrogen receptor agonist

Basic Description

SynonymsCCRIS 7203 | Estra-1,3,5(10)-triene-3,17alpha-diol | NCGC00161666-02 | Alfatradiol;Epiestradiol;Epiestrol | LMST02010029 | Oestra-1,3,5(10)-triene-3,17alpha-diol | 17.alpha.-Estradiol | 17alpha-E2 | Alfatradiol | alpha-Estradiol, powder, >=98% (TLC) | Oes
Specifications & PurityMoligand™, ≥98%
Biochemical and Physiological MechanismsEndogenous estrogen receptor ligand (Kivalues are 0.2 and 1.2 nM for ERαand ERβreceptors respectively).β-Estradiolalso available.
Storage TempStore at -20°C
Shipped InIce chest + Ice pads
GradeMoligand™
Product Description

Pharmaceutical secondary standards for application in quality control provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards

AI Insight

Associated Targets(Human)

ESR1 Tclin Estrogen receptor (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ESR2 Tclin Estrogen receptor beta (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ESR1 Tclin Estrogen receptor alpha (17718 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AR Tclin Androgen Receptor (11781 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ESR2 Tclin Estrogen receptor beta (9272 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HSD17B1 Tchem Estradiol 17-beta-dehydrogenase 1 (2224 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HSD17B7 Tchem 3-keto-steroid reductase (330 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GPER1 Tchem G-protein coupled estrogen receptor 1 (111 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
UGT1A1 Tchem UDP-glucuronosyltransferase 1-1 (448 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Associated Targets(non-human)

Nr1i2 Nuclear receptor subfamily 1 group I member 2 (14 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Mechanisms of Action

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Mechanism of ActionAction Typetarget IDTarget NameTarget TypeTarget OrganismBinding Site NameReferences

Names and Identifiers

Pubchem Sid504754299
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504754299
IUPAC Name (8R,9S,13S,14S,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
INCHI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17-,18+/m1/s1
InChi Key VOXZDWNPVJITMN-SFFUCWETSA-N
Canonical SMILES CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O
Isomeric SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@H]2O)CCC4=C3C=CC(=C4)O
WGK Germany 3
RTECS KG3750000
Alternate CAS 57-91-0
PubChem CID 68570
NSC Number 20293
MeSH Entry Terms alfatradiol
Molecular Weight 272.39

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

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

6 results found

Lot NumberCertificate TypeDateItem
H2212411Certificate of AnalysisJul 23, 2022 E194035
H2212412Certificate of AnalysisJul 23, 2022 E194035
H2212447Certificate of AnalysisJul 23, 2022 E194035
J2424320Certificate of AnalysisJul 23, 2022 E194035
K2301081Certificate of AnalysisJul 23, 2022 E194035
B2217105Certificate of AnalysisFeb 21, 2022 E194035

Chemical and Physical Properties

SolubilitySolvent:DMSO, Max Conc. mg/mL: 27.24, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 27.24, Max Conc. mM: 100
Specific Rotation[α]+46.0 to +52.0 deg(C=1, Dioxane)
Melt Point(°C)222.0 - 226.0 °C
Molecular Weight272.400 g/mol
XLogP34.000
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass272.178 Da
Monoisotopic Mass272.178 Da
Topological Polar Surface Area40.500 Ų
Heavy Atom Count20
Formal Charge0
Complexity382.000
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1

Safety and Hazards(GHS)

Pictogram(s) GHS08,   GHS07
Signal Danger
Hazard Statements

H351:Suspected of causing cancer

H302:Harmful if swallowed

H312:Harmful in contact with skin

H332:Harmful if inhaled

H360:May damage fertility or the unborn child

H361:Suspected of damaging fertility or the unborn child

H362:May cause harm to breast-fed children

Precautionary Statements

P261:Avoid breathing dust/fume/gas/mist/vapors/spray.

P280:Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352:IF ON SKIN: wash with plenty of water.

P321:Specific treatment (see ... on this label).

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.

P271:Use only outdoors or in a well-ventilated area.

P270:Do not eat, drink or smoke when using this product.

P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P362+P364:Take off contaminated clothing and wash it before reuse.

P330:Rinse mouth.

P263:Avoid contact during pregnancy/while nursing.

P203:Obtain, read and follow all safety instructions before use.

P301+P317:IF SWALLOWED: Get medical help.

P318:if exposed or concerned, get medical advice.

P317:Get emergency medical help.

WGK Germany 3
RTECS KG3750000

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Citations of This Product(7)

1. Xian Liu, Like Chen, Yang Yang, Liping Xu, Junyong Sun, Tian Gan.  (2023)  MXene−reinforced octahedral PtCu nanocages with boosted electrocatalytic performance towards endocrine disrupting pollutants sensing.  JOURNAL OF HAZARDOUS MATERIALS,  442  (130000).  [PMID:36137886] [10.1016/j.jhazmat.2022.130000]
2. Yanqun Yang, Yipeng Huang, Zhuqiang Wu, Rui Shi, Zhengyi Chen, Guihua Ruan.  (2022)  Porous capillary monolithic column coupled with ultrahigh performance liquid chromatography-tandem mass spectrometry for fast and effective separation and determination of estrogens.  ANALYTICA CHIMICA ACTA,  1227  (340270).  [PMID:36089309] [10.1016/j.aca.2022.340270]
3. Xianze Wang, Zhongmou Liu, Zhian Ying, Mingxin Huo, Wu Yang.  (2018)  Adsorption of Trace Estrogens in Ultrapure and Wastewater Treatment Plant Effluent by Magnetic Graphene Oxide.  International Journal of Environmental Research and Public Health,  15  (7): (1454).  [PMID:29996530] [10.3390/ijerph15071454]
4. Hailong Peng, Mei Luo, Hua Xiong, Ningxiang Yu, Fangjian Ning, Jieping Fan, Zheling Zeng, Jinhua Li, Lingxin Chen.  (2016)  Preparation of photonic-magnetic responsive molecularly imprinted microspheres and their application to fast and selective extraction of 17β-estradiol.  JOURNAL OF CHROMATOGRAPHY A,  1442  (1).  [PMID:27000739] [10.1016/j.chroma.2016.03.003]
5. Fangjian Ning, Hailong Peng, Jinhua Li, Lingxin Chen, Hua Xiong.  (2014)  Molecularly Imprinted Polymer on Magnetic Graphene Oxide for Fast and Selective Extraction of 17β-Estradiol.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,  62  (30): (7436–7443).  [PMID:25017481] [10.1021/jf501845w]
6. Xiaoxiao Wang,Huachun Liu,Zhian Sun,Shanwen Zhao,Yanqiang Zhou,Jianmin Li,Tianpei Cai,Bolin Gong.  (2020-06-25)  Monodisperse restricted access material with molecularly imprinted surface for selective solid-phase extraction of 17β-estradiol from milk..  Journal of separation science,  43  ((17)): (3520-3533).  [PMID:32579267]
7. Bing Wang,Huanxiang Yuan,Chunlei Zhu,Qiong Yang,Fengting Lv,Libing Liu,Shu Wang.  (2012-10-26)  Polymer-drug conjugates for intracellar molecule-targeted photoinduced inactivation of protein and growth inhibition of cancer cells..  Scientific reports,  (766-766).  [PMID:23097688]

References

1. Xian Liu, Like Chen, Yang Yang, Liping Xu, Junyong Sun, Tian Gan.  (2023)  MXene−reinforced octahedral PtCu nanocages with boosted electrocatalytic performance towards endocrine disrupting pollutants sensing.  JOURNAL OF HAZARDOUS MATERIALS,  442  (130000).  [PMID:36137886] [10.1016/j.jhazmat.2022.130000]
2. Yanqun Yang, Yipeng Huang, Zhuqiang Wu, Rui Shi, Zhengyi Chen, Guihua Ruan.  (2022)  Porous capillary monolithic column coupled with ultrahigh performance liquid chromatography-tandem mass spectrometry for fast and effective separation and determination of estrogens.  ANALYTICA CHIMICA ACTA,  1227  (340270).  [PMID:36089309] [10.1016/j.aca.2022.340270]
3. Xianze Wang, Zhongmou Liu, Zhian Ying, Mingxin Huo, Wu Yang.  (2018)  Adsorption of Trace Estrogens in Ultrapure and Wastewater Treatment Plant Effluent by Magnetic Graphene Oxide.  International Journal of Environmental Research and Public Health,  15  (7): (1454).  [PMID:29996530] [10.3390/ijerph15071454]
4. Hailong Peng, Mei Luo, Hua Xiong, Ningxiang Yu, Fangjian Ning, Jieping Fan, Zheling Zeng, Jinhua Li, Lingxin Chen.  (2016)  Preparation of photonic-magnetic responsive molecularly imprinted microspheres and their application to fast and selective extraction of 17β-estradiol.  JOURNAL OF CHROMATOGRAPHY A,  1442  (1).  [PMID:27000739] [10.1016/j.chroma.2016.03.003]
5. Fangjian Ning, Hailong Peng, Jinhua Li, Lingxin Chen, Hua Xiong.  (2014)  Molecularly Imprinted Polymer on Magnetic Graphene Oxide for Fast and Selective Extraction of 17β-Estradiol.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,  62  (30): (7436–7443).  [PMID:25017481] [10.1021/jf501845w]
6. Xiaoxiao Wang,Huachun Liu,Zhian Sun,Shanwen Zhao,Yanqiang Zhou,Jianmin Li,Tianpei Cai,Bolin Gong.  (2020-06-25)  Monodisperse restricted access material with molecularly imprinted surface for selective solid-phase extraction of 17β-estradiol from milk..  Journal of separation science,  43  ((17)): (3520-3533).  [PMID:32579267]
7. Bing Wang,Huanxiang Yuan,Chunlei Zhu,Qiong Yang,Fengting Lv,Libing Liu,Shu Wang.  (2012-10-26)  Polymer-drug conjugates for intracellar molecule-targeted photoinduced inactivation of protein and growth inhibition of cancer cells..  Scientific reports,  (766-766).  [PMID:23097688]

Solution Calculators