Search

Exact match only
± (example: 123 ± 1)
±  
±    
±    
Options
Single/Multi-component


Isotopically Labeled


Additional Filters

Search Hits Limit:
12 hits found in 0.19 seconds.
Search terms: MF = 'C_{31}H_{27}BrN_{2}O_{4}'
Finished
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3404172
InChI=1/C31H27BrN2O4/c1-31(2)15-22-27(23(35)16-31)26(19-11-12-24-25(13-19)38-17-37-24)28(29(36)18-7-4-3-5-8-18)30(33)34(22)21-10-6-9-20(32)14-21/h3-14,26H,15-17,33H2,1-2H3
C31H27BrN2O4571.46118800
12719712

Double-bond stereo
InChI=1/C31H27BrN2O4/c1-3-36-26-14-12-25(13-15-26)34-31(35)24(19-33)16-21-17-28(32)30(29(18-21)37-4-2)38-20-23-10-7-9-22-8-5-6-11-27(22)23/h5-18H,3-4,20H2,1-2H3,(H,34,35)/b24-16-
C31H27BrN2O4571.46117800
4102310
InChI=1/C31H27BrN2O4/c1-2-3-18-38-23-15-13-22(14-16-23)33-30(36)26-25-17-10-19-6-4-5-7-24(19)34(25)28(27(26)31(33)37)29(35)20-8-11-21(32)12-9-20/h4-17,25-28H,2-3,18H2,1H3
C31H27BrN2O4571.46115500
4159071
InChI=1/C31H27BrN2O4/c1-2-3-18-38-23-14-12-22(13-15-23)34-30(36)25-26(31(34)37)28(29(35)20-8-10-21(32)11-9-20)33-17-16-19-6-4-5-7-24(19)27(25)33/h4-17,25-28H,2-3,18H2,1H3
C31H27BrN2O4571.46115500
7983904

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C31H27BrN2O4/c1-19(21-11-12-23-16-24(37-2)14-13-22(23)15-21)30(35)38-29-25-9-6-10-27-28(25)34(18-26(29)32)31(36)33(27)17-20-7-4-3-5-8-20/h3-16,19,26,29H,17-18H2,1-2H3/t19-,26?,29+/m1/s1
C31H27BrN2O4571.46112200
8069971

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C31H27BrN2O4/c1-19(21-11-12-23-16-24(37-2)14-13-22(23)15-21)30(35)38-29-25-9-6-10-27-28(25)34(18-26(29)32)31(36)33(27)17-20-7-4-3-5-8-20/h3-16,19,26,29H,17-18H2,1-2H3/t19-,26-,29-/m1/s1
C31H27BrN2O4571.46112200
9367464

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C31H27BrN2O4/c1-19(21-11-12-23-16-24(37-2)14-13-22(23)15-21)30(35)38-29-25-9-6-10-27-28(25)34(18-26(29)32)31(36)33(27)17-20-7-4-3-5-8-20/h3-16,19,26,29H,17-18H2,1-2H3/t19-,26+,29+/m1/s1
C31H27BrN2O4571.46112200
1410550

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C31H27BrN2O4/c1-31(2)15-22-27(23(35)16-31)26(19-11-12-24-25(13-19)38-17-37-24)28(29(36)18-7-4-3-5-8-18)30(33)34(22)21-10-6-9-20(32)14-21/h3-14,26H,15-17,33H2,1-2H3/t26-/m1/s1
C31H27BrN2O4571.46112200
1410553

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C31H27BrN2O4/c1-31(2)15-22-27(23(35)16-31)26(19-11-12-24-25(13-19)38-17-37-24)28(29(36)18-7-4-3-5-8-18)30(33)34(22)21-10-6-9-20(32)14-21/h3-14,26H,15-17,33H2,1-2H3/t26-/m0/s1
C31H27BrN2O4571.46112200
12991094

Double-bond stereo
InChI=1/C31H27BrN2O4/c1-3-36-26-14-12-25(13-15-26)34-31(35)24(19-33)16-21-17-28(32)30(29(18-21)37-4-2)38-20-23-10-7-9-22-8-5-6-11-27(22)23/h5-18H,3-4,20H2,1-2H3,(H,34,35)/b24-16+
C31H27BrN2O4571.46111100
13013697

Double-bond stereo
InChI=1/C31H27BrN2O4/c1-3-36-26-14-12-25(13-15-26)34-31(35)24(19-33)16-23-17-29(37-4-2)30(18-28(23)32)38-20-22-10-7-9-21-8-5-6-11-27(21)22/h5-18H,3-4,20H2,1-2H3,(H,34,35)/b24-16-
C31H27BrN2O4571.46111100
22467012
InChI=1/C31H27BrN2O4/c1-19-18-21(32)10-17-27(19)33-30(35)28-25-6-4-5-7-26(25)31(36)34(22-11-15-24(38-3)16-12-22)29(28)20-8-13-23(37-2)14-9-20/h4-18,28-29H,1-3H3,(H,33,35)
C31H27BrN2O4571.46111100
Feedback Form