| SpectraBase Spectrum ID |
4j1vfm8x7v9 |
| Name |
NECA 3AC @ |
| Classification |
Adenosine receptor
agonist |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
434.154997065 u |
| Formula |
C18H22N6O7 |
| InChI |
InChI=1S/C18H22N6O7/c1-5-19-17(28)13-12(29-9(3)26)14(30-10(4)27)18(31-13)24-7-22-11-15(23-8(2)25)20-6-21-16(11)24/h6-7,12-14,18H,5H2,1-4H3,(H,19,28)(H,20,21,23,25) |
| InChIKey |
FUORDIYOYWTZPY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
434.409 g/mol |
| SMILES |
C1([n]2cnc3c2ncnc3NC(C)=O)OC(C(C1OC(C)=O)OC(C)=O)C(=O)NCC |
| SPLASH |
splash10-0f79-6953000000-6b8a40b57577659b8666 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
N-Ethylcarboxamido-adenosine 3AC
N-Ethylcarboxamido-adenosine 3AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_3091 |
