(2S)-3-(4-[(2S,4S,5S,3R,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)(2H-3,4,5,6-TETRAHYDROPYRAN-2-YLOXY)]-3-HYDROXYPHENYL)-2-AMINOPROPANOIC ACID

CAS No.
CCD No.
CCD00737989
Formula
C15 H21 N O9
MolWeight
359.329

Basic Information

Product Name: (2S)-3-(4-[(2S,4S,5S,3R,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)(2H-3,4,5,6-TETRAHYDROPYRAN-2-YLOXY)]-3-HYDROXYPHENYL)-2-AMINOPROPANOIC ACID
English Synonyms: 3'-O-(B-D-GLUCOPYRANOSYL)-L-DOPA ; 4'-O-(B-D-GLUCOPYRANOSYL)-L-DOPA ; (2S)-3-(4-[(2S,4S,5S,3R,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)(2H-3,4,5,6-TETRAHYDROPYRAN-2-YLOXY)]-3-HYDROXYPHENYL)-2-AMINOPROPANOIC ACID ; 4'-O-(BETA-D-GLUCOPYRANOSYL)-L-DOPA ; P-GLC-DOPA
MDL Number.: MFCD09263596
H bond acceptor: 10
H bond donor: 7
Smile: c1cc(c(cc1C[C@@H](C(=O)O)N)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChi: InChI=1S/C15H21NO9/c16-7(14(22)23)3-6-1-2-9(8(18)4-6)24-15-13(21)12(20)11(19)10(5-17)25-15/h1-2,4,7,10-13,15,17-21H,3,5,16H2,(H,22,23)/t7-,10+,11+,12-,13+,15+/m0/s1
InChiKey: InChIKey=FJAKCGVQVUUSPR-OLCQZNMOSA-N

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