EcoDrugPlus


Trade Names	ETHAMOLIN
Synonyms	Ethamolin Ethanolamine oleate NSC-760382
Status
Molecule Category	Salt-form
UNII	U4RY8MRX7C
EPA CompTox	DTXSID8023008

Trade Names

ETHAMOLIN

Synonyms

Ethamolin

Ethanolamine oleate

NSC-760382

Status

Molecule Category

Salt-form

UNII

U4RY8MRX7C

EPA CompTox

DTXSID8023008


InChI Key	KGWDUNBJIMUFAP-KVVVOXFISA-N
Smiles	CCCCCCCC/C=C\CCCCCCCC(=O)O.NCCO
InChI	InChI=1S/C18H34O2.C2H7NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;3-1-2-4/h9-10H,2-8,11-17H2,1H3,(H,19,20);4H,1-3H2/b10-9-;

InChI Key

KGWDUNBJIMUFAP-KVVVOXFISA-N

Smiles

CCCCCCCC/C=C\CCCCCCCC(=O)O.NCCO

InChI

InChI=1S/C18H34O2.C2H7NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;3-1-2-4/h9-10H,2-8,11-17H2,1H3,(H,19,20);4H,1-3H2/b10-9-;

Property Name	Value
Molecular Formula	C20H41NO3
Molecular Weight	343.55

Property Name

Value

Molecular Formula

C20H41NO3

Molecular Weight

343.55

Mechanism of Action	Action	Reference
Calcium chelating agent	CHELATING AGENT	PubMed DailyMed

Mechanism of Action

Action

Reference

Calcium chelating agent

CHELATING AGENT

PubMed DailyMed

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Unclassified protein	-	-	-	-	100-103

Targets

EC50(nM)

IC50(nM)

Kd(nM)

Ki(nM)

Inhibition(%)

Unclassified protein

100-103

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Escherichia coli	-	-	-	-	100-103

EC50(nM)

IC50(nM)

Kd(nM)

Ki(nM)

Inhibition(%)

Escherichia coli

100-103

Resources	Reference
ChEBI	50500
ChEMBL	CHEMBL3989529
DrugBank	DB06689
FDA SRS	U4RY8MRX7C
Guide to Pharmacology	1054
KEGG	C00712
PDB	OLA
PharmGKB	PA164746758
PubChem	5282489
SureChEMBL	SCHEMBL146090
ZINC	ZINC06845860

Resources

Reference

ChEBI

ChEMBL

DrugBank

FDA SRS

Guide to Pharmacology

KEGG

PDB

PharmGKB

PubChem

SureChEMBL

ZINC

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

ETHANOLAMINE OLEATE

Structure

Physicochemical Descriptors

Pharmacology

Cross References