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(8R,9S,13S,14S,16S,17R)-2-fluoranyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol
SpectraBase Compound ID 8TfQWBqg308
InChI InChI=1S/C18H23FO3/c1-18-5-4-10-11(13(18)8-16(21)17(18)22)3-2-9-6-15(20)14(19)7-12(9)10/h6-7,10-11,13,16-17,20-22H,2-5,8H2,1H3/t10-,11+,13-,16-,17-,18-/m0/s1
InChIKey BONDEGMYKPSULB-CCWAZTPESA-N
Mol Weight 306.38 g/mol
Molecular Formula C18H23FO3
Exact Mass 306.163123 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYCSxuQg95H
Name (8R,9S,13S,14S,16S,17R)-2-fluoranyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol
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Formula C18H23FO3
InChI InChI=1S/C18H23FO3/c1-18-5-4-10-11(13(18)8-16(21)17(18)22)3-2-9-6-15(20)14(19)7-12(9)10/h6-7,10-11,13,16-17,20-22H,2-5,8H2,1H3/t10-,11+,13-,16-,17-,18-/m0/s1
InChIKey BONDEGMYKPSULB-CCWAZTPESA-N
Molecular Weight 306.377 g/mol
SMILES O[C@@]1([C@]2(CC[C@@]3(c4cc(c(cc4CC[C@]3([C@@]2(C[C@@]1(O)[H])[H])[H])O)F)[H])C)[H]
SPLASH splash10-0a4i-0029000000-c77e2f8cf8abc8d26002
Source of Spectrum K-2002-662-12
Synonyms (8R,9S,13S,14S,16S,17R)-2-fluoro-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol
Wiley ID 1580967