| SpectraBase Spectrum ID |
EXxascJ89ET |
| Name |
21H,23H-Porphine-2,8,18-tripropanoic acid, 13-(ethoxycarbonyl)-3,7,12,17-tetramethyl-15-propyl-, trimethyl ester |
| Alternate Name(s) |
ethyl 9,15,19-tris(3-methoxy-3-oxopropyl)-5,10,14,20-tetramethyl-2-propyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1(21),2,4,6,8(23),9,11,13,15,17,19-undecaene-4-carboxylate
Trimethyl-13-ethoxycarbonyl-3,7,12,14-tetramethyl-15-propylporphyrin-2,8,18-tripropionate |
| CAS Registry Number |
104328-28-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H50N4O8 |
| InChI |
InChI=1S/C42H50N4O8/c1-10-12-29-40-24(5)28(15-18-38(49)53-9)35(46-40)21-34-27(14-17-37(48)52-8)23(4)31(44-34)19-30-22(3)26(13-16-36(47)51-7)33(43-30)20-32-25(6)39(41(29)45-32)42(50)54-11-2/h19-21,44-45H,10-18H2,1-9H3/b30-19-,31-19-,32-20-,33-20-,34-21-,35-21-,40-29-,41-29- |
| InChIKey |
FETPYLDUXIASRF-ULDWZTFKSA-N |
| Molecular Weight |
738.882 g/mol |
| SMILES |
[nH]1c2c(c3nc(cc4c(c(c(cc5nc(cc1c(c2C(=O)OCC)C)c(c5C)CCC(=O)OC)[nH]4)C)CCC(=O)OC)c(c3C)CCC(=O)OC)CCC |
| SPLASH |
splash10-000i-0000000900-1325f45c747ae4bf72db |
| Source of Spectrum |
B-39-430-0 |
| Wiley ID |
1416072 |
