Try beta.chemspider
- Charge
- Double-bond stereo
- 2 of 2 defined stereocentres
Calcium (3R,5S,6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl}-3,5-dihydroxy-6-heptenoate (6E)-7-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]-5- pyrimidinyl}-3,5-dihydroxy-6-heptenoate (1:1:1)
[Ca+2].CS(=O)(=O)N(C)C1=NC(C(C)C)=C(/C=C/[C@@H](O)C[C@@H](O)CC([O-])=O)C(=N1)C1C=CC(F)=CC=1.CS(=O)(=O)N(C)C1=NC(C(C)C)=C(/C=C/C(O)CC(O)CC([O-])=O)C(=N1)C1C=CC(F)=CC=1
InChI=1S/2C22H28FN3O6S.Ca/c2*1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32;/h2*5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30);/q;;+2/p-2/b2*10-9+;/t16-,17-;;/m1../s1
LALFOYNTGMUKGG-BZURYUANSA-L
CSID:74047119, http://www.chemspider.com/Chemical-Structure.74047119.html (accessed 22:27, Apr 23, 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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