1-Deoxy-1-[[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-β-D-glucopyranuronic acid
CAS Registry Number®
96735-72-7
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CAS Name
1-Deoxy-1-[[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-β-D-glucopyranuronic acidMolecular Formula
C22H24F3NO7Molecular Mass
471.42Cite this Page
1-Deoxy-1-[[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-β-D-glucopyranuronic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=96735-72-7 (retrieved ) (CAS RN: 96735-72-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C22H24F3NO7/c23-22(24,25)13-6-8-14(9-7-13)32-15(12-4-2-1-3-5-12)10-11-26-20-18(29)16(27)17(28)19(33-20)21(30)31/h1-9,15-20,26-29H,10-11H2,(H,30,31)/t15?,16-,17-,18+,19-,20+/m0/s1
InChIKey
InChIKey=GXZQMXPRYAFVRG-OJRVOLPLSA-N
SMILES
C(OC1=CC=C(C(F)(F)F)C=C1)(CCN[C@@H]2O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]2O)C3=CC=CC=C3
Canonical SMILES
O=C(O)C1OC(NCCC(OC2=CC=C(C=C2)C(F)(F)F)C=3C=CC=CC3)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranuronic acid, 1-deoxy-1-[[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-
- 1-Deoxy-1-[[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amino]-β-D-glucopyranuronic acid
