SpectraBase Spectrum ID |
pQBDHYvxNV |
Name |
Copper, [tetramethyl 3,8,13,18-tetramethyl-21H,23H-porphine-2,7,12,17-tetrapropanoato(2-)-N21,N22,N23,N24]-, (SP-4-1)- |
CAS Registry Number |
54111-68-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C40H44CuN4O8 |
InChI |
InChI=1S/C40H44N4O8.Cu/c1-21-25(9-13-37(45)49-5)33-18-31-23(3)27(11-15-39(47)51-7)35(43-31)20-36-28(12-16-40(48)52-8)24(4)32(44-36)19-34-26(10-14-38(46)50-6)22(2)30(42-34)17-29(21)41-33;/h17-20H,9-16H2,1-8H3;/q-2;+2/b29-17-,30-17+,31-18-,32-19-,33-18-,34-19-,35-20+,36-20-; |
InChIKey |
OXYHTUYTTTVPHW-GZCAKDEPSA-N |
Molecular Weight |
772.358 g/mol |
SMILES |
COC(=O)CCc1c(C)c2cc3nc(cc4c(C)c(CCC(=O)OC)c([n-]4)cc4nc(cc1[n-]2)c(C)c4CCC(=O)OC)c(CCC(=O)OC)c3C.[Cu+2] |
SPLASH |
splash10-00di-0000001900-4e2c4f7a39a2214ab5a7 |
Source of Spectrum |
W5-38559-26977-26977 |
Wiley ID |
1416733 |