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3-Methoxy-14.alpha.-hydroxy-D-homo-1,3,5(10)-estratrien-17a-one
SpectraBase Compound ID InOOAIeDOfh
InChI InChI=1S/C20H26O3/c1-19-11-9-16-15-7-6-14(23-2)12-13(15)5-8-17(16)20(19,22)10-3-4-18(19)21/h6-7,12,16-17,22H,3-5,8-11H2,1-2H3/t16?,17?,19?,20-/m1/s1
InChIKey DIIYVLKCTQKMEU-OZNCTZQZSA-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 1PEAtPeK4dk
Name 3-Methoxy-14.alpha.-hydroxy-D-homo-1,3,5(10)-estratrien-17a-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-19-11-9-16-15-7-6-14(23-2)12-13(15)5-8-17(16)20(19,22)10-3-4-18(19)21/h6-7,12,16-17,22H,3-5,8-11H2,1-2H3/t16?,17?,19?,20-/m1/s1
InChIKey DIIYVLKCTQKMEU-OZNCTZQZSA-N
Molecular Weight 314.425 g/mol
SMILES O[C@@]12C(CCC3c4c(cc(cc4)OC)CCC13)(C(=O)CCC2)C
SPLASH splash10-0002-0091000000-11c7b9a7c9daed962663
Source of Spectrum G-56-1519-0
Synonyms (4aR)-4a-hydroxy-8-methoxy-12a-methyl-3,4,4a,4b,5,6,10b,11,12,12a-decahydro-1(2H)-chrysenone
Wiley ID 748290