CAS Number
Molecular Formula
C44H50N4O10
Product format
Neat
Molecular Weight
794.90
Shipping
Room Temperature
API Family
Synonyms
Conophylline; 142741-24-0; dimethyl (2R, 6R, 11R, 13S, 14S, 23S, 24S, 25S, 36R, 39R, 40R)-14, 25-diethyl-24, 33-dihydroxy-31, 32-dimethoxy-12, 22-dioxa-1, 9, 18, 29-tetrazadodecacyclo[23.13.1.16, 9.02, 23.03, 21.05, 19.06, 17.011, 13.028, 36.030, 35.036, 39.014, 40]tetraconta-3, 5(19), 16, 20, 27, 30, 32, 34-octaene-16, 27-dicarboxylate; dimethyl (2R, 6R, 11R, 13S, 14S, 23S, 24S, 25S, 36R, 39R, 40R)-14, 25-diethyl-24, 33-dihydroxy-31, 32-dimethoxy-12, 22-dioxa-1, 9, 18, 29-tetrazadodecacyclo(23.13.1.16, 9.02, 23.03, 21.05, 19.06, 17.011, 13.028, 36.030, 35.036, 39.014, 40)tetraconta-3, 5(19), 16, 20, 27, 30, 32, 34-octaene-16 and 27-dicarboxylate; RefChem:127795; DTXSID501337310; Cophylline; CHEMBL506768; SCHEMBL29456823; SCHEMBL30036820; HY-N3619; AKOS032962004
Iupac Name
dimethyl (2R, 6R, 11R, 13S, 14S, 23S, 24S, 25S, 36R, 39R, 40R)-14, 25-diethyl-24, 33-dihydroxy-31, 32-dimethoxy-12, 22-dioxa-1, 9, 18, 29-tetrazadodecacyclo[23.13.1.16, 9.02, 23.03, 21.05, 19.06, 17.011, 13.028, 36.030, 35.036, 39.014, 40]tetraconta-3, 5(19), 16, 20, 27, 30, 32, 34-octaene-16 and 27-dicarboxylate
InChI
InChI=1S/C44H50N4O10/c1-7-41-16-20(37(51)55-5)34-44(23-14-25(49)30(53-3)31(54-4)28(23)46-34)10-12-48(40(41)44)29-19-13-22-24(15-26(19)57-32(29)35(41)50)45-33-21(38(52)56-6)17-42(8-2)36-27(58-36)18-47-11-9-43(22,33)39(42)47/h13-15,27,29,32,35-36,39-40,45-46,49-50H,7-12,16-18H2,1-6H3/t27-,29-,32+,35-,36-,39+,40+,41-,42-,43+,44+/m1/s1
