| SpectraBase Spectrum ID |
G3LiPmuQchM |
| Name |
Guanosine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
118-00-3
484-80-0
85-30-3 |
| ChEBI ID |
16750 |
| Comments |
saturated N/A guanosine - vendor: Sigma g6752; Solvent: D2O; Temperature=298 K, pH=10.5; NMR Reference: 500 uM DSS; Bruker DMX 400MHz
(Data collected by Madison Metabolomics Consortium) |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C10 H13 N5 O5 |
| IUPAC Name |
2-amino-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one; 2-amino-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one; 2-amino-9-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one |
| InChI |
InChI=1S/C10H13N5O5/c11-10-13-7-4(8(19)14-10)12-2-15(7)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H3,11,13,14,19)/t3-,5-,6-,9-/m1/s1 |
| InChIKey |
NYHBQMYGNKIUIF-UUOKFMHZSA-N |
| KEGG Compound ID |
C00387 |
| KEGG Pathways |
PATH: map00230 Purine metabolism |
| PubChem Compound ID |
6802 |
| SMILES |
C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=NC2=O)N |
| Source File Reference |
bmse000091 |
