DIETHYL STILBESTROL BETA-D-GLUCURONIDE

CAS No.
2408-40-4
CCD No.
CCD00042373
Formula
C24 H28 O8
MolWeight
444.477

Basic Information

Product Name: DIETHYL STILBESTROL BETA-D-GLUCURONIDE
CAS: 2408-40-4
English Synonyms: DIETHYL STILBESTROL BETA-D-GLUCURONIDE ; DIETHYLSTILBESTROL MONOGLUCURONIDE ; STILBESTROL MONOGLUCURONIDE ; 4-[(1E)-1-ETHYL-2-(4-HYDROXYPHENYL)-1-BUTEN-1-YL]PHENYL BETA-D-GLUCOPYRANOSIDURONIC ACID
MDL Number.: MFCD00063847
H bond acceptor: 8
H bond donor: 5
Smile: CC/C(=C(/CC)\c1ccc(cc1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)/c3ccc(cc3)O
InChi: InChI=1S/C24H28O8/c1-3-17(13-5-9-15(25)10-6-13)18(4-2)14-7-11-16(12-8-14)31-24-21(28)19(26)20(27)22(32-24)23(29)30/h5-12,19-22,24-28H,3-4H2,1-2H3,(H,29,30)/b18-17+/t19-,20-,21+,22-,24+/m0/s1
InChiKey: InChIKey=LJMPVHCKUXKZAV-PDSLVOJVSA-N

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