α-Estradiol
19
Reference
α-Estradiol Structure
Systematic / IUPAC Name: (17α)-Estra-1(10),2,4-triene-3,17-diol
ID: Reference19
Other Names:
3,17-Dihydroxyestratriene;
3,17α-Dihydroxyestra-1,3,5(10)-triene;
Epiestradiol;
Estradiol-17α;
17-α-Estradiol
; more
Formula: C18H24O2
Spectral Data
α-Estradiol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Elite |
| No. of Spectral Trees | 2 |
| No. of Spectra | 1125 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 10/29/2014 9:26:57 AM |
Identificators
| 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 | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O |
| CAS | 57910 |
| Splash | |
| Other Names |
3,17-Dihydroxyestratriene; 3,17α-Dihydroxyestra-1,3,5(10)-triene; Epiestradiol; Estradiol-17α; 17-α-Estradiol; Epiestradial; Epiestrol Estra-1,3,5(10)-triene-3,17α-diol; 1,3,5(10)-Estratriene-3,17α-diol; (17α)-Estra-1,3,5(10)-triene-3,17-diol; Alfatradiol; Epiestrol |