Dataset

GUANOSINEMONOPHOSPHATE

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P102101_EF88 contains the MS2 mass spectrum of GUANOSINEMONOPHOSPHATE with the InChIkey RQFCJASXJCIDSX-UUOKFMHZSA-N.

Chemical Info

InChI	InChI=1S/C10H14N5O8P/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
SMILES	NC1=NC2=C(N=CN2[C@@H]2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2O)C(=O)N1
InChI Key	RQFCJASXJCIDSX-UUOKFMHZSA-N
Molecular Formula	C10H14N5O8P
Exact Mass	363.058 g/mol

Data and Resources

GUANOSINEMONOPHOSPHATEHTML
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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P102101_EF88
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:29:25.587142
MetadataModified	2025-02-08T18:45:56.283562
MetadataPublished	2021-12-23

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
135398631	PubChem
J10.615A	Nikkaji
CIQYEH	CCDC
50010318	BindingDB
5123	Guide to Pharmacology
DTXSID9044295	EPA CompTox Dashboard
HY-N5134	MedChemExpress
426061	BindingDB
ZINC000002159505	ZINC
C00144	KEGG Ligand
G	PDBe
5GP	PDBe
17345	ChEBI
CHEMBL283807	ChEMBL
60020700	NMRShiftDB
PD051028	ProbesDrugs
CpG	Atlas
16014337	PubChem: Thomson Pharma
29593-02-0	ACToR
25191-14-4	ACToR
16002058	PubChem: Thomson Pharma
14901517	PubChem: Thomson Pharma
573-48-8	ACToR
29480205	eMolecules
5747772	eMolecules
SCHEMBL5854	SureChEMBL
16597955EP	FDA SRS
14093	Brenda
27054	Brenda
100656	Brenda
96075	Brenda
MTBLC17345	Metabolights
CB6271952	ChemicalBook
HMDB0001397	Human Metabolome Database
37344	Brenda
SCHEMBL19222125	SureChEMBL
5973	Brenda
162	Brenda
DB01972	DrugBank
1022	Brenda
The data in this table is sourced from UniChem at EBI.