EcoDrugPlus


Synonyms	9-cis-retinal acetate 9-cis-retinyl acetate 9-cis-vitamin a acetate 9-cis-vitamin a1 acetate QLT-091001 QLT091001 Qlt091001 Zuretinol acetate
Status
Molecule Category	Free-form
UNII	2K3YP54BYU


InChI Key	QGNJRVVDBSJHIZ-AQDFTDIISA-N
Smiles	CC(=O)OC/C=C(C)/C=C/C=C(C)\C=C\C1=C(C)CCCC1(C)C
InChI	InChI=1S/C22H32O2/c1-17(9-7-10-18(2)14-16-24-20(4)23)12-13-21-19(3)11-8-15-22(21,5)6/h7,9-10,12-14H,8,11,15-16H2,1-6H3/b10-7+,13-12+,17-9-,18-14+

Property Name	Value
Molecular Formula	C22H32O2
Molecular Weight	328.5
AlogP	6.08
Hydrogen Bond Acceptor	2.0
Number of Rotational Bond	6.0
Polar Surface Area	26.3
Molecular species	NEUTRAL
Aromatic Rings	0.0
Heavy Atoms	24.0

Mechanism of Action	Action	Reference
Molecule (9-cis-retinol) replacement	None	Other Other

Resources	Reference
ChEMBL	CHEMBL4297637
DrugBank	DB12112
FDA SRS	2K3YP54BYU
Human Metabolome Database	HMDB0035185
PubChem	10245972
SureChEMBL	SCHEMBL1173917
ZINC	ZINC000014685555

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

ZURETINOL ACETATE

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

Cross References