Try beta.chemspider
- 3 of 3 defined stereocentres
- Non-standard isotope
[3-({(2R,3S)-2-{(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy}-3-[4-fluoro(~2~H_4_)phenyl]-4-morpholinyl}methyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]phosphonic acid - 1-deoxy-1-(methylamino)-D-glu citol (1:2)
C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@H](C3=C([2H])C([2H])=C(C([2H])=C3[2H])F)N(CCO2)CC4=NC(=O)N(N4)P(=O)(O)O.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O [2H]c1c(c(c(c(c1[C@H]2[C@H](OCCN2Cc3[nH]c(=O)n(n3)P(=O)(O)O)O[C@H](C)c4cc(cc(c4)C(F)(F)F)C(F)(F)F)[2H])[2H])F)[2H].CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
InChI=1S/C23H22F7N4O6P.2C7H17NO5/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)40-20-19(13-2-4-17(24)5-3-13)33(6-7-39-20)11-18-31-21(35)34(32-18)41(36,37)38;2*1-8-2-4(10)6(12)7(13)5(11)3-9/h2-5,8-10,12,19-20H,6-7,11H2,1H3,(H,31,32,35)(H2,36,37,38);2*4-13H,2-3H2,1H3/t12-,19+,20-;2*4-,5+,6+,7+/m100/s1/i2D,3D,4D,5D;;
VRQHBYGYXDWZDL-FZRVXCFOSA-N
CSID:58793399, http://www.chemspider.com/Chemical-Structure.58793399.html (accessed 06:26, Jun 1, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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