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(14beta,17beta)-3-methoxy-17-methylestra-1,3,5(10),8-tetraene-14,17-diol
SpectraBase Compound ID GbUCSMTTIrp
InChI InChI=1S/C20H26O3/c1-18-9-8-16-15-6-5-14(23-3)12-13(15)4-7-17(16)20(18,22)11-10-19(18,2)21/h5-7,12,16,21-22H,4,8-11H2,1-3H3/t16?,18-,19+,20+/m1/s1
InChIKey AJENQGZKRGYEPU-BTSWOQPFSA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QOI5OzvF2
Name (14beta,17beta)-3-methoxy-17-methylestra-1,3,5(10),8-tetraene-14,17-diol
Alternate Name(s) 17-.alpha.-Methyl-3-methoxy-estra-1,3,5(10),8(9)-tetraene-14.beta.,17.beta.-diol 17.alpha.-Methyl-3-methoxy-estra-1,3,5(10),7(8)-tetraene-14.beta.,17.beta.-diol
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Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-18-9-8-16-15-6-5-14(23-3)12-13(15)4-7-17(16)20(18,22)11-10-19(18,2)21/h5-7,12,16,21-22H,4,8-11H2,1-3H3/t16?,18-,19+,20+/m1/s1
InChIKey AJENQGZKRGYEPU-BTSWOQPFSA-N
Molecular Weight 314.425 g/mol
SMILES O[C@@]1([C@]2(CCC3C([C@]2(CC1)O)=CCc1cc(ccc31)OC)C)C
SPLASH splash10-01ot-0095000000-4a00d65fa53e838e499d
Source of Spectrum F9-1993-211-14
Wiley ID 1566698