Tolcapone-β-D-Glucuronide

Product Name Tolcapone-β-D-Glucuronide
Alternate Names Tolcapone Glucuronides, Glucuronides of Tolcapone
CAT No. CS-O-30506
CAS No. 204853-33-8
Category Glucuronides
Stock IN-Stock
Mol. Wt. Not Available
Mol. For. C20H19NO11
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Tolcapone
Therapeutic Anti-Parkinsons
Smileys OC1=C([N](=O)=O)C=C(C(C2=CC=C(C)C=C2)=O)C=C1O[C@@H]([C@@H]([C@@H](O)[C@@H]3O)O)O[C@@H]3C(O)=O
Canonical Smiles CC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)OC3C(C(C(C(O3)C(=O)O)O)O)O)O)[N+](=O)[O-]
InchIKey QQQCXCUCFPMHBX-HBWRTXEVSA-N
Inchl InChI=1S/C20H19NO11/c1-8-2-4-9(5-3-8)13(22)10-6-11(21(29)30)14(23)12(7-10)31-20-17(26)15(24)16(25)18(32-20)19(27)28/h2-7,15-18,20,23-26H,1H3,(H,27,28)/t15-,16-,17+,18-,20+/m0/s1
IUPAC (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenoxy]oxane-2-carboxylic acid
Controlled No
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