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(13S)-methyl 3-methoxy-13-methyl-17-oxo-16-(6-(tetrahydro-2H-pyran-2-yloxy)hexyl)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-16-carboxylate
SpectraBase Compound ID EJXKsIlyAQz
InChI InChI=1S/C32H46O6/c1-31-17-15-25-24-14-12-23(35-2)20-22(24)11-13-26(25)27(31)21-32(29(31)33,30(34)36-3)16-7-4-5-8-18-37-28-10-6-9-19-38-28/h12,14,20,25-28H,4-11,13,15-19,21H2,1-3H3/t25?,26?,27?,28?,31-,32?/m0/s1
InChIKey HWDGXQJAWAONGW-VCLZRRKDSA-N
Mol Weight 526.7 g/mol
Molecular Formula C32H46O6
Exact Mass 526.329439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSi8ig2sFuD
Name (13S)-methyl 3-methoxy-13-methyl-17-oxo-16-(6-(tetrahydro-2H-pyran-2-yloxy)hexyl)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-16-carboxylate
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Formula C32H46O6
InChI InChI=1S/C32H46O6/c1-31-17-15-25-24-14-12-23(35-2)20-22(24)11-13-26(25)27(31)21-32(29(31)33,30(34)36-3)16-7-4-5-8-18-37-28-10-6-9-19-38-28/h12,14,20,25-28H,4-11,13,15-19,21H2,1-3H3/t25?,26?,27?,28?,31-,32?/m0/s1
InChIKey HWDGXQJAWAONGW-VCLZRRKDSA-N
Molecular Weight 526.714 g/mol
SMILES C1(C([C@]2(CCC3C(C2C1)CCc1cc(OC)ccc31)C)=O)(C(=O)OC)CCCCCCOC1OCCCC1
SPLASH splash10-00dr-0019000000-2d4e01227960dbfeec93
Source of Spectrum G2-3-519-25
Synonyms 6-[3'-methoxy-17'-oxo-16.alpha./.beta.-(methoxycarbonyl)-1',3',5'(10')-estratrien-16'-.alpha./.beta.-yl]-1-[(tetrahydro-2'H-pyran-2'-yl)oxy]hexane 6-[3-methoxy-17-oxo-16-(methoxycarbonyl)-1,3,5(10)-estratrien-16-yl]-1-[(tetrahydro-2H-pyran-2-yl)oxy]hexane
Wiley ID 1661455