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Amb33874472

Duplicate ID
CAS Number 1000023-04-0
Molecule Name 2-(2-Chloro-4-(trifluoromethyl)phenyl)-5,7-dihydroxy-8-((2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl)-4H-chromen-4-one
1000023-04-0
2-[2-chloro-4-(trifluoromethyl)phenyl]-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-4H-1-benzopyran-4-one
P1446A-05
SmilesCN1CC[C@H]([C@@H]1CO)c1c2OC(=CC(=O)c2c(O)cc1O)c1ccc(cc1Cl)C(F)(F)F
InchiKeyMRPGRAKIAJJGMM-OCCSQVGLSA-N
InChi InChI=1S/C22H19ClF3NO5/c1-27-5-4-12(14(27)9-28)19-15(29)7-16(30)20-17(31)8-18(32-21(19)20)11-3-2-10(6-13(11)23)22(24,25)26/h2-3,6-8,12,14,28-30H,4-5,9H2,1H3/t12-,14+/m1/s1
Formula C22H19ClF3NO5
Molecular weight 469.838
Rings 4
logP 4.2613
PSA 94.14
MR 116.838
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