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Estra-1,3,5(10)-triene-2-methanol, 17-hydroxy-3-(2-methoxyethoxy)-.alpha.,.alpha.-dimethyl-, (17.beta.)-
SpectraBase Compound ID 17Mpexu2fv7
InChI InChI=1S/C24H36O4/c1-23(2,26)20-14-18-15(13-21(20)28-12-11-27-4)5-6-17-16(18)9-10-24(3)19(17)7-8-22(24)25/h13-14,16-17,19,22,25-26H,5-12H2,1-4H3/t16-,17+,19-,22-,24-/m0/s1
InChIKey BEHVHPICVNLWLH-MJFIPZRTSA-N
Mol Weight 388.5 g/mol
Molecular Formula C24H36O4
Exact Mass 388.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6BLopmUqJsW
Name Estra-1,3,5(10)-triene-2-methanol, 17-hydroxy-3-(2-methoxyethoxy)-.alpha.,.alpha.-dimethyl-, (17.beta.)-
CAS Registry Number 119829-57-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-23(2,26)20-14-18-15(13-21(20)28-12-11-27-4)5-6-17-16(18)9-10-24(3)19(17)7-8-22(24)25/h13-14,16-17,19,22,25-26H,5-12H2,1-4H3/t16-,17+,19-,22-,24-/m0/s1
InChIKey BEHVHPICVNLWLH-MJFIPZRTSA-N
Molecular Weight 388.548 g/mol
SMILES OC(c1cc2c(CC[C@]3([C@]4([C@@]([C@](CC4)(O)[H])(CC[C@]23[H])C)[H])[H])cc1OCCOC)(C)C
SPLASH splash10-0ab9-8109000000-fd38702b98235383e26e
Source of Spectrum B-41-1147-4
Synonyms 2-(1-Hydroxy-1-methylethyl)estra-1,3,5(10)-triene-3,17.beta.-diol-3-methoxyethyl ether 2-[(17beta)-17-hydroxy-3-(2-methoxyethoxy)estra-1,3,5(10)-trien-2-yl]-2-propanol
Wiley ID 1364042