Dataset

10-hydroxy-Camptothecin

This MassBank record with Accession MSBNK-Washington_State_Univ-BML82445 contains the MS mass spectrum of 10-hydroxy-Camptothecin with the InChIkey HAWSQZCWOQZXHI-FQEVSTJZSA-N.

Chemical Info

InChI	InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1
SMILES	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)O)O
InChI Key	HAWSQZCWOQZXHI-FQEVSTJZSA-N
Molecular Formula	C20H16N2O5
Exact Mass	364.106 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-BML82445
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:21:10.973791
MetadataModified	2025-02-09T20:05:37.337699
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
16124509	PubChem: Thomson Pharma
19685-09-7	ACToR
SCHEMBL25875	SureChEMBL
70005121	NMRShiftDB
PD001274	ProbesDrugs
LSM-4685	LINCS
10-hydroxycamptothecin	Selleck
2725974	eMolecules
29542718	eMolecules
97226	PubChem
9Z01632KRV	FDA SRS
DB12385	DrugBank
29298	Brenda
CB4445430	ChemicalBook
ZINC000003979155	ZINC
CB12129661	ChemicalBook
227935	Brenda
50008922	BindingDB
10-HYDROXYCAMPTOTHECIN	clinicaltrials
HYDROXYCAMPTOTHECIN	clinicaltrials
YAWYAA	CCDC
81395	ChEBI
J3.021.724A	Nikkaji
J258.662B	Nikkaji
HY-N0095	MedChemExpress
CHEMBL273862	ChEMBL
C17939	KEGG Ligand
12015125	PubChem: Drugs of the Future
The data in this table is sourced from UniChem at EBI.