| SpectraBase Spectrum ID |
Hwl5DVuGmsl |
| Name |
21H-Biline-8,12-dipropanoic acid, 3,17-diethyl-1,19,22,24-tetrahydro-2,7,13,18-tetramethyl-1,19-dioxo-, dihexadecyl ester |
| Alternate Name(s) |
(Z,Z,Z)-1,19-dioxo-2,7,13,18-tetramethyl-3,17-diethyl-8,12-bis(hexadecyloxycarbonyl-2-ethyl)-1,19,22,24-tetrahydro-21H-biline
Hexadecyl 3-[(2E)-5-{[(2E)-3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-2-[(5-{[(2E)-3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-3-[3-(hexadecyloxy)-3-oxopropyl]-4-methyl-1H-pyrrol-2-yl)methylidene]-4-methyl-2H-pyrrol-3-yl]propanoate |
| CAS Registry Number |
109332-82-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C65H102N4O6 |
| InChI |
InChI=1S/C65H102N4O6/c1-9-13-15-17-19-21-23-25-27-29-31-33-35-37-43-74-62(70)41-39-54-48(5)56(45-58-52(11-3)50(7)64(72)68-58)66-60(54)47-61-55(49(6)57(67-61)46-59-53(12-4)51(8)65(73)69-59)40-42-63(71)75-44-38-36-34-32-30-28-26-24-22-20-18-16-14-10-2/h45-47,66H,9-44H2,1-8H3,(H,68,72)(H,69,73)/b58-45+,59-46+,61-47+ |
| InChIKey |
LMWDALJHOVDXSV-UPVXXKSUSA-N |
| Molecular Weight |
1035.553 g/mol |
| SMILES |
N1C(C(=C(\C1=C\C1=N\C(=C\c2c(c(c(\C=C\3NC(C(=C3CC)C)=O)[nH]2)C)CCC(=O)OCCCCCCCCCCCCCCCC)C(=C1C)CCC(=O)OCCCCCCCCCCCCCCCC)CC)C)=O |
| SPLASH |
splash10-03di-2020090000-09ad7c01fad2584eb66e |
| Source of Spectrum |
AH-117-1083-2 |
| Wiley ID |
1418477 |
