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Found 17 results

Search term: MF = 'C_{21}H_{31}N_{3}O_{9}'
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10056870

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C21H31N3O9/c22-19(32)12(3-4-16(27)28)24-20(33)11-7-13(18(31)14(25)8-11)23-15(26)9-21(10-17(29)30)5-1-2-6-21/h7,12-14,18,25,31H,1-6,8-10H2,(H2,22,32)(H,23,26)(H,24,33)(H,27,28)(H,29,30)/t12-,13+,14+,18+/m0/s1
C21H31N3O9469.48559600
58430
InChI=1/C19H29N3O5.C2H2O4/c1-20(2)18(24)13-21-7-9-22(10-8-21)17(23)6-5-14-11-15(26-3)19(25)16(12-14)27-4;3-1(4)2(5)6/h11-12,25H,5-10,13H2,1-4H3;(H,3,4)(H,5,6)
C21H31N3O9469.485545500
170942

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H31N3O9/c25-15-11-33-21(32,18(28)17(15)27)12-22-9-5-4-8-14(20(30)31)24-16(26)10-23-19(29)13-6-2-1-3-7-13/h1-3,6-7,14-15,17-18,22,25,27-28,32H,4-5,8-12H2,(H,23,29)(H,24,26)(H,30,31)/t14-,15-,17-,18+,21-/m1/s1
C21H31N3O9469.48555500
2321168
InChI=1/C17H27N3O.2C2H2O4/c1-3-17(21)20(16-9-6-5-7-10-16)14-13-19-12-8-11-18(4-2)15-19;2*3-1(4)2(5)6/h5-7,9-10H,3-4,8,11-15H2,1-2H3;2*(H,3,4)(H,5,6)
C21H31N3O9469.485544400
2677161

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C21H31N3O9/c22-19(32)12(3-4-16(27)28)24-20(33)11-7-13(18(31)14(25)8-11)23-15(26)9-21(10-17(29)30)5-1-2-6-21/h7,12-14,18,25,31H,1-6,8-10H2,(H2,22,32)(H,23,26)(H,24,33)(H,27,28)(H,29,30)
C21H31N3O9469.485542100
57451889

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H23N3O.2C4H4O4/c1-3-4-10(2)7-14-8-12-13-11(5-6-17-12)15-9-16-13;2*5-3(6)1-2-4(7)8/h9-10,12,14H,3-8H2,1-2H3,(H,15,16);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+
C21H31N3O9469.48552200
8587813

4 of 7 defined stereocentres - 4/7 defined
InChI=1/C21H31N3O9/c1-2-3-8-32-20(29)14(15-16(26)21(30)10-33-19(17(21)27)24(15)31)23-18(28)13(22)9-11-4-6-12(25)7-5-11/h4-7,13-17,19,25-27,30-31H,2-3,8-10,22H2,1H3,(H,23,28)/t13-,14?,15?,16-,17+,19?,21+/m0/s1
C21H31N3O9469.48552100
8847371

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C21H31N3O9/c1-2-3-8-32-20(29)14(15-16(26)21(30)10-33-19(17(21)27)24(15)31)23-18(28)13(22)9-11-4-6-12(25)7-5-11/h4-7,13-17,19,25-27,30-31H,2-3,8-10,22H2,1H3,(H,23,28)/t13-,14?,15-,16-,17-,19-,21+/m0/s1
C21H31N3O9469.48552100
67034024

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C21H31N3O9/c1-10(26)15(20(30)22-3)24-21(31)32-9-12-6-4-5-7-13(12)19-16(23-11(2)27)18(29)17(28)14(8-25)33-19/h4-7,10,14-19,25-26,28-29H,8-9H2,1-3H3,(H,22,30)(H,23,27)(H,24,31)/t10-,14-,15+,16-,17-,18-,19+/m1/s1
C21H31N3O9469.48551100
68024832

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H31N3O9/c25-15-11-33-21(32,18(28)17(15)27)12-22-9-5-4-8-14(20(30)31)24-16(26)10-23-19(29)13-6-2-1-3-7-13/h1-3,6-7,14-15,17-18,22,25,27-28,32H,4-5,8-12H2,(H,23,29)(H,24,26)(H,30,31)/t14?,15-,17-,18+,21-/m0/s1
C21H31N3O9469.48551100
101120604

Double-bond stereo
InChI=1/C21H31N3O9/c1-16-12-18(14-22-23-19(25)15-24(27)28)13-17(2)21(16)33-20(26)4-5-30-8-9-32-11-10-31-7-6-29-3/h12-14H,4-11,15H2,1-3H3,(H,23,25)/b22-14-
C21H31N3O9469.48551100
8066501

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C11H15NO4.C10H14N2O4.H2O/c1-2-16-11(15)8(12)5-7-3-4-9(13)10(14)6-7;1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6;/h3-4,6,8,13-14H,2,5,12H2,1H3;2-4,12-14H,5,11H2,1H3,(H,15,16);1H2/t8-;10-;/m00./s1
C21H31N3O9469.48551100
16524382

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H31N3O9/c1-21(2,3)33-20(31)23-14(12-26)19(30)24(9-10-25)17(13-7-5-6-8-15(13)27)18(29)22-11-16(28)32-4/h5-8,14,17,25-27H,9-12H2,1-4H3,(H,22,29)(H,23,31)
C21H31N3O9469.48551100
16524442

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H31N3O9/c1-21(2,3)33-20(31)23-15(12-26)19(30)24(8-9-25)17(13-6-5-7-14(27)10-13)18(29)22-11-16(28)32-4/h5-7,10,15,17,25-27H,8-9,11-12H2,1-4H3,(H,22,29)(H,23,31)
C21H31N3O9469.48551100
16524457

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H31N3O9/c1-21(2,3)33-20(31)23-15(12-26)19(30)24(9-10-25)17(13-5-7-14(27)8-6-13)18(29)22-11-16(28)32-4/h5-8,15,17,25-27H,9-12H2,1-4H3,(H,22,29)(H,23,31)
C21H31N3O9469.48551100
29317265

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C21H31N3O9/c25-17(16-5-2-1-3-6-16)11-22(9-10-24(14-20(30)31)15-21(32)33)7-4-8-23(12-18(26)27)13-19(28)29/h1-3,5-6,17,25H,4,7-15H2,(H,26,27)(H,28,29)(H,30,31)(H,32,33)
C21H31N3O9469.48551100

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