| SpectraBase Spectrum ID |
ACE1m5LsdGj |
| Name |
Estra-1,3,5(10)-triene-3,17-diol, 2-chloro-4-methoxy-, (17.beta.)- |
| Alternate Name(s) |
(17beta)-2-chloro-4-methoxyestra-1,3,5(10)-triene-3,17-diol
2-Chloro-4-methoxyestra-1,3,5(10)-triene-3,17.beta.-diol |
| CAS Registry Number |
123764-10-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H25ClO3 |
| InChI |
InChI=1S/C19H25ClO3/c1-19-8-7-10-11(14(19)5-6-16(19)21)3-4-12-13(10)9-15(20)17(22)18(12)23-2/h9-11,14,16,21-22H,3-8H2,1-2H3/t10-,11+,14-,16-,19-/m0/s1 |
| InChIKey |
RHACNARQVCAORT-REICZXOASA-N |
| Molecular Weight |
336.859 g/mol |
| SMILES |
Oc1c(c2c([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CC2)[H])[H])(O)[H])C)[H])cc1Cl)OC |
| SPLASH |
splash10-000i-0029000000-4905df698e04236bb590 |
| Source of Spectrum |
B-42-432-26 |
| Wiley ID |
1332404 |
