Products 182507-20-6

CAS 182507-20-6 appears in our catalog under these names: Raloxifene 4',6-bis-beta-D-glucuronide, Raloxifene 6,4’-Bis-Beta-D-glucuronide, Raloxifene 6,4'-bis-b-D-glucuronide, Raloxifene 6,4''-bis-b-D-glucuronide, Raloxifene 6,4'-Bis-β-D-glucuronide. Offered by: Iris Biotech, TRC, Biosynth, Chemat, MedChemExpress. Available pack sizes: 2mg, 5mg, 10mg, 1mg, 1 mg.

Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-6-[4-[6-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 182507-20-6) is a chemical compound with the molecular formula C40H43NO16S and a molecular weight of 825.8 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[4-[6-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: PCIAOPAUTIPRHI-SLTHDDBBSA-N.

Identity
Molecular formulaC40H43NO16S
Molecular weight825.8 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[4-[6-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyPCIAOPAUTIPRHI-SLTHDDBBSA-N
SMILESC1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C6=CC=C(C=C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O

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