| SpectraBase Spectrum ID |
2rLPj3CWEZI |
| Name |
Bronzaphyrin NS |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C46H55N5S |
| InChI |
InChI=1S/C46H55N5S/c1-5-9-11-13-17-33-27-41-39-23-24-40(51-39)42-28-34(18-14-12-10-6-2)38(48-42)22-20-36-32(16-8-4)30-44(50-36)46-26-25-45(52-46)43-29-31(15-7-3)35(49-43)19-21-37(33)47-41/h19-30,47,50-51H,5-18H2,1-4H3/b21-19-,22-20-,35-19-,36-20-,37-21-,38-22-,41-39-,42-40-,45-43-,46-44- |
| InChIKey |
SXKPSHMOWQYCHO-AFKGQIMASA-N |
| Molecular Weight |
710.041 g/mol |
| SMILES |
[nH]1c2-c3cc(c(\C=C/C4=NC(=C5SC(=C6C=C(\C(=C\C=C\7N=C(c1cc2)C=C7CCCCCC)N6)CCC)C=C5)C=C4CCC)[nH]3)CCCCCC |
| SPLASH |
splash10-03di-0000001900-5d1c55cb38d441ff5387 |
| Source of Spectrum |
J-62-1172-4 |
| Synonyms |
8,27-dihexyl-13,22-dipropyl-31-thia-29,30,32,33,34-pentaazaheptacyclo[24.2.1.1(2,5).1(6,9).1(12,15).1(16,19).1(20,23)]tetratriaconta-1(29),2,4,6,8,10,12(32),13,15,17,19,21,23,25,27-pentadecaene |
| Wiley ID |
1415322 |
