Estriol structure, CAS 50-27-1

Estriol

CAS Number50-27-1

Synonyms16α-Estriol; OVESTIN; TRIOVEX; (16a,17b)-Estra-1,3,5(10)-triene-3,16,17-triol; 16a-Hydroxyestradiol; Tridestrin; Oestriol; Thulol; Ovo-Vinces; Colpogyn; Orestin; MFCD00003691; oekolp; Theelol; E 3; Estriol; 16α,17β-Estriol; OE3; (16α,17β)-Oestra-1,3,5(10)-triene-3,16,17-triol; 16α-Hydroxyestradiol; Aacifemine; Holin; Ortho-Gynest; 16a-Estriol; Estratriol; Estra-1,3,5(10)-triene-3,16α,17β-triol; Gynasan; Klimax E; trans-Estriol; Estra-1,3,5(10)-triene-3,16a,17b-triol

Molecular FormulaC18H24O3

Molecular Weight288.38

Purity98%

Density1.3±0.1 g/cm3

Boiling Point469.0±45.0 °C at 760 mmHg

Melting Point280-282 °C (lit.)

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

Symbol6.1

Signal WordWarning

Cat. No.: 2A-9010388 Purity: 98%
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Quality Control of [ 50-27-1 ] Purity: 98% SDS Specification MoL

Chemical & Physical Properties
CAS Number50-27-1
Catalog No.2A-9010388
Chinese Name雌三醇
Synonyms16α-Estriol; OVESTIN; TRIOVEX; (16a,17b)-Estra-1,3,5(10)-triene-3,16,17-triol; 16a-Hydroxyestradiol; Tridestrin; Oestriol; Thulol; Ovo-Vinces; Colpogyn; Orestin; MFCD00003691; oekolp; Theelol; E 3; Estriol; 16α,17β-Estriol; OE3; (16α,17β)-Oestra-1,3,5(10)-triene-3,16,17-triol; 16α-Hydroxyestradiol; Aacifemine; Holin; Ortho-Gynest; 16a-Estriol; Estratriol; Estra-1,3,5(10)-triene-3,16α,17β-triol; Gynasan; Klimax E; trans-Estriol; Estra-1,3,5(10)-triene-3,16a,17b-triol
Molecular FormulaC18H24O3
Molecular Weight288.38
Purity98
Density1.3±0.1 g/cm3
Boiling Point469.0±45.0 °C at 760 mmHg
Melting Point280-282 °C (lit.)
Appearancepowder
Water SolubilityWater solubility: insoluble; soluble in: methanol;
Storage ConditionThis product is sealed and stored in a dry place a
ApplicationEstriol is a G protein-coupled estrogen receptor antagonist that can act on estrogen receptor-negative breast cancer cells.
MDL NumberMFCD00003691
SMILESC[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1C[C@@H](O)[C@@H]2O
InChI1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1
InChI KeyPROQIPRRNZUXQM-ZXXIGWHRSA-N
Beilstein/REAXYS2508172
NACRES CodeNA.24
UNSPSC41116107
Hazard Symbols6.1
MSDSmsds/10388_1_50_27_1.pdf
BioactivityEstriol is an antagonist of the G-protein coupled estrogen receptor in estrogen receptor-negative breast cancer cells.Target: Estrogen Receptor/ERRA recent study shows that estrogen (estrone, estradiol, and estriol) inhibits Alzheimer's disease-associated low-order Aβ oligomer formation, and among them, estriol shows the strongest in vitro activity [1]. In mPTEN± mice, estriol treatments resulted in a 187.54% gain in the relative ratio of uterine wet weight to body weight; estriol also increases the ratio to 176.88% in wild-type mice [2]. Estriol treatment (20 mg/kg ip), in vivo, sensitizes Kupffer cells to LPS via mechanisms dependent on an increase in CD14 by elevated portal blood endotoxin caused by increased gut permeability in rats; while one-half of the rats given estriol intraperitoneally 24 hours before an injection of a sublethal dose of LPS (5 mg/kg) died within 24 hours [3]. Related Catalog Signaling Pathways >> Others >> Estrogen Receptor/ERR Natural Products >> Others Research Areas >> Cancer Target Human Endogenous Metabolite References [1]. Morinaga, A., et al., Effects of sex hormones on Alzheimer's disease-associated beta-amyloid oligomer formation in vitro. Exp Neurol, 2011. 228(2): p. 298-302. [2]. Begum, M., et al., Neonatal estrogenic exposure suppresses PTEN-related endometrial carcinogenesis in recombinant mice. Lab Invest, 2006. 86(3): p. 286-96. [3]. Hewitt, S.C. and K.S. Korach, Estrogenic activity of bisphenol A and 2,2-bis(p-hydroxyphenyl)-1,1,1-trichloroethane (HPTE) demonstrated in mouse uterine gene profiles. Environ Health Perspect, 2011. 119(1): p. 63-70. Chemical & Physical Properties Density 1.3±0.1 g/cm3 Boiling Point 469.0±45.0 °C at 760 mmHg Melting Point 280-282 °C(lit.) Molecular Formula C18H24O3 Molecular Weight 288.381 Flash Point 220.8±23.3 °C Exact Mass 288.172546 PSA 60.69000 LogP 2.94 Vapour Pressure 0.0±1.2 mmHg at 25°C Index of Refraction 1.624 InChIKey PROQIPRRNZUXQM-ZXXIGWHRSA-N SMILES CC12CCC3c4ccc(O)cc4CCC3C1CC(O)C2O Storage condition -20°C Freezer
Use ofProperties Articles131 Name estriol Synonym More Synonyms Estriol Biological Activity Related Catalog Signaling Pathways >> Others >> Estrogen Receptor/ERR Natural Products >> Others Research Areas >> Cancer Human Endogenous Metabolite References [1]. Morinaga, A., et al., Effects of sex hormones on Alzheimer's disease-associated beta-amyloid oligomer formation in vitro. Exp Neurol, 2011. 228(2): p. 298-302. [2]. Begum, M., et al., Neonatal estrogenic exposure suppresses PTEN-related endometrial carcinogenesis in recombinant mice. Lab Invest, 2006. 86(3): p. 286-96. [3]. Hewitt, S.C. and K.S. Korach, Estrogenic activity of bisphenol A and 2,2-bis(p-hydroxyphenyl)-1,1,1-trichloroethane (HPTE) demonstrated in mouse uterine gene profiles. Environ Health Perspect, 2011. 119(1): p. 63-70. Chemical & Physical Properties Molecular Formula C18H24O3 Exact Mass 288.172546 PSA 60.69000 Index of Refraction 1.624 InChIKey PROQIPRRNZUXQM-ZXXIGWHRSA-N
Transport InfoProduct name: Purity: 98.0%
MSDS Transport InfoModule 14. Shipping information United Nations classification: inconsistent with United Nations classification standards UN number: not specified
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