Dataset

Cytidine-2',3'-monophosphoric acid

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81031 contains the MS mass spectrum of Cytidine-2',3'-monophosphoric acid with the InChIkey UOOOPKANIPLQPU-XVFCMESISA-N.

Chemical Info

InChI	InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-6(14)7(4(3-13)19-8)20-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
SMILES	C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)(O)O)O
InChI Key	UOOOPKANIPLQPU-XVFCMESISA-N
Molecular Formula	C9H14N3O8P
Exact Mass	323.052 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81031
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:21:56.026956
MetadataModified	2024-01-11T22:21:56.178219
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
84-52-6	ACToR
66535	PubChem
PD060206	ProbesDrugs
14899429	PubChem: Thomson Pharma
16690333	PubChem: Thomson Pharma
6DZL5I6D4D	FDA SRS
53013	ChEBI
20201462	NMRShiftDB
SCHEMBL79966	SureChEMBL
716928	eMolecules
161098	Brenda
CB0383198	ChemicalBook
MTBLC53013	Metabolights
34806	Brenda
DB01961	DrugBank
2000	Brenda
C05822	KEGG Ligand
CHEMBL258728	ChEMBL
C3P	PDBe
CYTIAC	CCDC
50233301	BindingDB
HMDB0240312	Human Metabolome Database
J4.895J	Nikkaji
ZINC000004096919	ZINC
The data in this table is sourced from UniChem at EBI.