ACETYLCARNITINE

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Search structure


Synonyms	Acetyl carnitine hcl Acetyl-L-Carnitine Acetyl-l-carnitine Acetylcarnitine Branigen Levacecarnine hydrochloride NSC-747431 Nicetile Normobren Oristar ach ST-200 Zibren
Status
Molecule Category	Free-form
ATC	N06BX12
UNII	6DH1W9VH8Q
EPA CompTox	DTXSID1040956

Structure


InChI Key	RDHQFKQIGNGIED-MRVPVSSYSA-N
Smiles	CC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C
InChI	InChI=1S/C9H17NO4/c1-7(11)14-8(5-9(12)13)6-10(2,3)4/h8H,5-6H2,1-4H3/t8-/m1/s1

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C9H17NO4
Molecular Weight	203.24
AlogP	-1.24
Hydrogen Bond Acceptor	4.0
Number of Rotational Bond	5.0
Polar Surface Area	66.43
Molecular species	ACID
Aromatic Rings	0.0
Heavy Atoms	14.0

Pharmacology

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides	-	-	-	-	113.18-187.77

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Cricetulus griseus	-	-	-	-	113.18-187.77

Cross References

Resources	Reference
ChEBI	57589
ChEMBL	CHEMBL1697733
DrugBank	DB08842
DrugCentral	64
FDA SRS	6DH1W9VH8Q
Human Metabolome Database	HMDB0000201
Guide to Pharmacology	4520
PubChem	7045767
SureChEMBL	SCHEMBL118455

CONTENTS

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...

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Last update: Monday, 3 November 2025