| SpectraBase Spectrum ID |
FWdgHMFGwyB |
| Name |
21H,23H-Porphine-2,8,12-tripropanoic acid, 3,7,13,18-tetramethyl-, trimethyl ester |
| Alternate Name(s) |
2,6,7-tris-(2-methoxycarbonylethyl)-1,3,5,8-tetramethylporphin
methyl 3-[10,14-bis(3-methoxy-3-oxopropyl)-5,9,15,20-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-4-yl]propanoate |
| CAS Registry Number |
62786-94-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H40N4O6 |
| InChI |
InChI=1S/C36H40N4O6/c1-19-14-23-15-28-20(2)24(8-11-34(41)44-5)32(38-28)18-33-26(10-13-36(43)46-7)22(4)30(40-33)17-29-21(3)25(9-12-35(42)45-6)31(39-29)16-27(19)37-23/h14-18,38-39H,8-13H2,1-7H3/b23-15-,27-16-,28-15-,29-17-,30-17-,31-16-,32-18-,33-18- |
| InChIKey |
GMHDEQZLFQJBNQ-BYHPYUHVSA-N |
| Molecular Weight |
624.738 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4C)CCC(=O)OC)c(c3CCC(=O)OC)C)c(c1)C)C)CCC(=O)OC |
| SPLASH |
splash10-00di-0000029000-2d29fe1951a249fa2047 |
| Source of Spectrum |
KC-1976-2500-0 |
| Wiley ID |
1411783 |
