SpectraBase Compound ID | 1fldbtkTogp |
---|---|
InChI | InChI=1S/C24H26N4O13/c1-21(2)37-11-8-5-6-9-12-14(40-22(3,4)38-12)17(36-9)28-20(32)26-18(30)24(33,34)23(6,28)41-10-7(5)27(19(31)25-15(10)29)16(35-8)13(11)39-21/h5-6,8-9,11-14,16-17,33-34H,1-4H3,(H,25,29,31)(H,26,30,32)/t5-,6+,8?,9-,11+,12?,13+,14?,16?,17-,23-/m1/s1 |
InChIKey | JCPGIKVJXSPKGL-NVYLZTBUSA-N |
Mol Weight | 578.49 g/mol |
Molecular Formula | C24H26N4O13 |
Exact Mass | 578.149637 g/mol |
SpectraBase Spectrum ID | zrriartLS2 |
---|---|
Name | JCPGIKVJXSPKGL-NVYLZTBUSA-N |
Compound Number | 22A |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C24H26N4O13 |
InChI | InChI=1S/C24H26N4O13/c1-21(2)37-11-8-5-6-9-12-14(40-22(3,4)38-12)17(36-9)28-20(32)26-18(30)24(33,34)23(6,28)41-10-7(5)27(19(31)25-15(10)29)16(35-8)13(11)39-21/h5-6,8-9,11-14,16-17,33-34H,1-4H3,(H,25,29,31)(H,26,30,32)/t5-,6+,8?,9-,11+,12?,13+,14?,16?,17-,23-/m1/s1 |
InChIKey | JCPGIKVJXSPKGL-NVYLZTBUSA-N |
Literature Reference Author | I.M.SASSON,R.P.GAGNIER,B.A.OTTER |
Literature Reference Citation | J.HETCYCL.CHEM.,20,753(1983) |
Literature Reference DOI | 10.1002/jhet.5570200346 |
Molecular Weight | 578.489 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWCS7117 |