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RALOXIFENE 6-GLUCURONIDE

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Name: RALOXIFENE 6-GLUCURONIDE
CAS: 174264-50-7
Synonyms: 2-(4-HYDROXYPHENYL)-3-[4-[2-(1-PIPERIDINYL)ETHOXYBENZOYL]BENZO[B]THIEN-6-YL]-BETA-D-GLUCOPYRANOSIDURONIC ACID ; RALOXIFENE 6'-D-GLUCURONIDE ; RALOXIFENE 6-GLUCURONIDE ; RALOXIFENE 6-BETA-D-GLUCURONIDE ; RALOXIFENE 6'-GLUCURONIDE
MDL.: MFCD00946709
H bond acceptor: 11
H bond donor: 5
Smile: c1cc(ccc1c2c(c3ccc(cc3s2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)C(=O)c5ccc(cc5)OCCN6CCCCC6)O
InChi: InChI=1S/C34H35NO10S/c36-21-8-4-20(5-9-21)32-26(27(37)19-6-10-22(11-7-19)43-17-16-35-14-2-1-3-15-35)24-13-12-23(18-25(24)46-32)44-34-30(40)28(38)29(39)31(45-34)33(41)42/h4-13,18,28-31,34,36,38-40H,1-3,14-17H2,(H,41,42)/t28-,29-,30+,31-,34+/m0/s1
InChiKey: InChIKey=MZPMSLSINDGEPM-WKRHDJAJSA-N

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