Dataset

trans-Zeatin

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00882 contains the MS2 mass spectrum of trans-Zeatin with the InChIkey UZKQTCBAMSWPJD-FARCUNLSSA-N.

Chemical Info

InChI	InChI=1S/C10H13N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h2,5-6,16H,3-4H2,1H3,(H2,11,12,13,14,15)/b7-2+
SMILES	C/C(=C\CNC1=NC=NC2=C1NC=N2)/CO
InChI Key	UZKQTCBAMSWPJD-FARCUNLSSA-N
Molecular Formula	C10H13N5O
Exact Mass	219.112 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-BML00882
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:25:31.236237
MetadataModified	2024-01-11T22:25:31.405271
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
J3.243.127E	Nikkaji
DTXSID9040631	EPA CompTox Dashboard
CB1497498	ChemicalBook
ZEATIN	rxnorm
HY-19700	MedChemExpress
ZINC000004492895	ZINC
MTBLC16522	Metabolights
15687	Brenda
2877	Brenda
2421	Brenda
152565	Brenda
HMDB0012204	Human Metabolome Database
227637	BindingDB
16522	Rhea
DB11337	DrugBank
CB8177373	ChemicalBook
449093	PubChem
PD021464	ProbesDrugs
trans-zeatin	Atlas
t-zeatin	Atlas
7I6OOJ9GR6	FDA SRS
1637-39-4	ACToR
SCHEMBL49689	SureChEMBL
15172105	PubChem: Thomson Pharma
J7.540J	Nikkaji
10017747	NMRShiftDB
C00371	KEGG Ligand
CHEMBL525239	ChEMBL
16522	ChEBI
ZEA	PDBe
713885	eMolecules
26749692	eMolecules
The data in this table is sourced from UniChem at EBI.