(8R,9S,13S,14S,16R,17R)-16-(123I)iodanyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
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(8R,9S,13S,14S,16R,17R)-16-(123I)iodanyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
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CAS No:
85853-22-1
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Formula:
C18H23IO2
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Chemical Name:
(8R,9S,13S,14S,16R,17R)-16-(123I)iodanyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
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Synonyms:
UNII-YJC612NTL3;YJC612NTL3;85853-22-1;16alpha-Iodoestradiol I-123;DTXSID401006433;Estra-1,3,5(10)-triene-3,17-diol, 16-(iodo-123I)-, (16alpha,17beta)-;16-(~123~I)Iodoestra-1(10),2,4-triene-3,17-diol
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CAS No:
(8R,9S,13S,14S,16R,17R)-16-(123I)iodanyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol Basic Attributes
394.3 g/mol
394.07539 g/mol
YJC612NTL3
Computed Properties
Molecular Weight:394.3
XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:394.07539
Monoisotopic Mass:394.07539
Topological Polar Surface Area:40.5
Heavy Atom Count:21
Complexity:414
Isotope Atom Count:1
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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