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| | 16α-Estriol-13C3 (16α-Hydroxyestradiol-[2,3,4-13C3]) (CertiMass solution) Basic information |
| Product Name: | 16α-Estriol-13C3 (16α-Hydroxyestradiol-[2,3,4-13C3]) (CertiMass solution) | | Synonyms: | 16α-Estriol-13C3 (16α-Hydroxyestradiol-[2,3,4-13C3]) (CertiMass solution);16α-Hydroxyestradiol-[2,3,4-13C3](estriol-13C3);Estriol-[13C3] (16α-Hydroxyestradiol-[2,3,4-13C3]);(8R,9S,13S,14S,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol;Estriol-2,3,4-13C3
;ESTRIOL (16 ALPHA-HYDROXYESTRADIOL) 97% PURITY (2,3,4-13C3, 99%) 100 UG/ML IN METHANOL;16α-Hydroxyestradiol-[2,3,4-13C3] (Solution);ESTRIOL (16 ALPHA-HYDROXYESTRADIOL) (2,3,4-13C3,99%) CHEMICAL PURITY 97% | | CAS: | 1255639-56-5 | | MF: | C18H24O3 | | MW: | 291.36 | | EINECS: | | | Product Categories: | | | Mol File: | 1255639-56-5.mol | ![16α-Estriol-13C3 (16α-Hydroxyestradiol-[2,3,4-13C3]) (CertiMass solution) Structure](CAS/20180808/GIF/1255639-56-5.gif) |
| | 16α-Estriol-13C3 (16α-Hydroxyestradiol-[2,3,4-13C3]) (CertiMass solution) Chemical Properties |
| Melting point | 280-282°C (lit.) | | density | 1.256±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) | | storage temp. | -20°C | | form | powder | | InChI | 1S/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/i3+1,8+1,11+1 | | InChIKey | PROQIPRRNZUXQM-FDFADMNFSA-N | | SMILES | C[C@]12CC[C@H]3[C@@H](CCc4[13cH][13c](O)[13cH]cc34)[C@@H]1C[C@@H](O)[C@@H]2O | | CAS Number Unlabeled | 50-27-1 |
| Hazard Codes | T | | Risk Statements | 60-61-40 | | Safety Statements | 53-36/37-45 | | WGK Germany | 3 | | Storage Class | 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects | | Hazard Classifications | Carc. 2
Repr. 1B |
| | 16α-Estriol-13C3 (16α-Hydroxyestradiol-[2,3,4-13C3]) (CertiMass solution) Usage And Synthesis |
| Uses | Estriol-13C3 is the 13C-labeled Estriol. Estriol is an antagonist of the G-protein coupled estrogen receptor in estrogen receptor-negative breast cancer cells. | | References | [1] Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216. DOI:10.1177/1060028018797110
[2] 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. DOI:10.1016/j.expneurol.2011.01.011
[3] Begum, M., et al., Neonatal estrogenic exposure suppresses PTEN-related endometrial carcinogenesis in recombinant mice. Lab Invest, 2006. 86(3): p. 286-96. DOI:10.1038/labinvest.3700380
[4] 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. DOI:10.1289/ehp.1002347 |
| | 16α-Estriol-13C3 (16α-Hydroxyestradiol-[2,3,4-13C3]) (CertiMass solution) Preparation Products And Raw materials |
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