| SpectraBase Spectrum ID |
CY6K3YirmPi |
| Name |
21H,23H-Porphine-2,18-diacetic acid, 20-(acetyloxy)-3,7,8,12,13,17-hexamethyl-, diethyl ester |
| CAS Registry Number |
53727-85-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H40N4O6 |
| InChI |
InChI=1S/C36H40N4O6/c1-10-44-32(42)12-24-21(7)30-15-28-19(5)17(3)26(37-28)14-27-18(4)20(6)29(38-27)16-31-22(8)25(13-33(43)45-11-2)35(40-31)36(34(24)39-30)46-23(9)41/h14-16,37,40H,10-13H2,1-9H3/b26-14-,27-14-,28-15-,29-16-,30-15-,31-16-,36-34+,36-35+ |
| InChIKey |
AGCKIIQURHYWER-XEGJVRPFSA-N |
| Molecular Weight |
624.738 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2OC(=O)C)c(c4C)CC(=O)OCC)c(c3C)C)c(c1C)C)C)CC(=O)OCC |
| SPLASH |
splash10-0540-0000290000-fa16534368968e0eb446 |
| Source of Spectrum |
W-0-1-695 |
| Synonyms |
.gamma.-Acetoxy-6,7-bis[(ethoxycarbonyl)methyl]-1,2,3,4,5,8-hexamethylporphyrin
.gamma.-acetoxy-6,7-di(ethoxycarbonylmethyl)-1,2,3,4,5,8-hexamethylporphyrin
Ethyl[2-(acetyloxy)-20-(2-ethoxy-2-oxoethyl)-5,9,10,14,15,19-hexamethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaen-4-yl]acetate |
| Wiley ID |
754074 |
