Elagolix
Product Code
TRC-E501180-500MG
CAS Number
Product Format
Neat
Molecular Formula
C32 H30 F5 N3 O5
Molecular Weight
631.59
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
Elagolix
CAS Number
834153-87-6
Molecular Formula
C32 H30 F5 N3 O5
Molecular Weight
631.59
Accurate Mass
631.211
SMILES
COc1cccc(C2=C(C)N(Cc3c(F)cccc3C(F)(F)F)C(=O)N(C[C@H](NCCCC(=O)O)c4ccccc4)C2=O)c1F
InChI
InChI=1S/C32H30F5N3O5/c1-19-28(21-11-6-14-26(45-2)29(21)34)30(43)40(18-25(20-9-4-3-5-10-20)38-16-8-15-27(41)42)31(44)39(19)17-22-23(32(35,36)37)12-7-13-24(22)33/h3-7,9-14,25,38H,8,15-18H2,1-2H3,(H,41,42)/t25-/m0/s1
IUPAC
4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoic acid
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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