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Found 9 results

Search term: MF = 'C_{21}H_{31}ClN_{6}O_{4}'
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
112880

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C21H31ClN6O4/c22-12-18(30)16(3-1-9-26-21(24)25)27-19(31)17-4-2-10-28(17)20(32)15(23)11-13-5-7-14(29)8-6-13/h5-8,15-17,29H,1-4,9-12,23H2,(H,27,31)(H4,24,25,26)/t15-,16+,17+/m1/s1
C21H31ClN6O4466.9616161300
145175
InChI=1/C13H20N2O2.C8H10N4O2.ClH/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11;1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;/h5-8H,3-4,9-10,14H2,1-2H3;4H,1-3H3;1H
C21H31ClN6O4466.9616494800
8271644

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C21H31ClN6O4/c1-2-3-4-5-6-16(31)27-8-7-13(10-27)24-18-17-19(26-21(22)25-18)28(12-23-17)20-15(30)9-14(11-29)32-20/h12-15,20,29-30H,2-11H2,1H3,(H,24,25,26)/t13?,14-,15+,20+/m0/s1
C21H31ClN6O4466.96162100
103831990

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H30N6O4.ClH/c1-20(12-21(31-11-15(20)28)6-8-22-9-7-21)25-17(29)10-16-24-19-23-14-5-3-2-4-13(14)18(30)27(19)26-16;/h15,22,28H,2-12H2,1H3,(H,25,29)(H,23,24,26);1H/t15-,20-;/m0./s1
C21H31ClN6O4466.96162100
123260222
InChI=1/C21H31ClN6O4/c1-21(2,3)28-19(25-20(26-28)27(10-12-31-4)11-13-32-5)24-17(29)14-23-18(30)15-6-8-16(22)9-7-15/h6-9H,10-14H2,1-5H3,(H,23,30)(H,24,25,26,29)
C21H31ClN6O4466.96161100
124699838

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31ClN6O4/c1-29-11-8-28(9-12-30-2)21-26-19(23-14-16-5-4-10-32-16)25-20(27-21)24-15-6-7-18(31-3)17(22)13-15/h6-7,13,16H,4-5,8-12,14H2,1-3H3,(H2,23,24,25,26,27)
C21H31ClN6O4466.96161100
32898379

Double-bond stereo
InChI=1/C21H31ClN6O4/c1-6-9-27-19(23)17(20(30)24-21(27)31)26(10-11-32-5)16(29)8-7-15-14(4)25-28(18(15)22)12-13(2)3/h7-8,13H,6,9-12,23H2,1-5H3,(H,24,30,31)/b8-7+
C21H31ClN6O4466.96161100
99278253

Double-bond stereo
InChI=1/C21H31ClN6O4/c1-5-28(23)19(30)13-18(29)25-24-14-15-6-7-16(12-17(15)22)26-8-10-27(11-9-26)20(31)32-21(2,3)4/h6-7,12,14H,5,8-11,13,23H2,1-4H3,(H,25,29)/b24-14-
C21H31ClN6O4466.96161100
102214020

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C21H31ClN6O4/c1-32-16(29)5-3-2-4-6-23-19(31)26-25-17(30)20-8-14-7-15(9-20)11-21(10-14,12-20)28-13-24-18(22)27-28/h13-15H,2-12H2,1H3,(H,25,30)(H2,23,26,31)
C21H31ClN6O4466.96161100

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