ETRETINATE

Search structure
Trade Names:
Synonyms:
Status: Approved (1986) Withdrawn (1989)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: D05BB01
UNII: 65M2UDR9AG

Structure
InChI Key HQMNCQVAMBCHCO-DJRRULDNSA-N
Smile CCOC(=O)/C=C(C)/C=C/C=C(C)/C=C/c1c(C)cc(OC)c(C)c1C
InChI
InChI=1S/C23H30O3/c1-8-26-23(24)14-17(3)11-9-10-16(2)12-13-21-18(4)15-22(25-7)20(6)19(21)5/h9-15H,8H2,1-7H3/b11-9+,13-12+,16-10+,17-14+

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H30O3
Molecular Weight 354.49
AlogP 5.65
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 7.0
Polar Surface Area 35.53
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 26.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Retinoid receptor agonist PubMed PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

MCS

Cross References

Resources Reference
CAS NUMBER 54350-48-0
ChEBI 4913
ChEMBL CHEMBL464
DrugCentral 1116
EPA CompTox DTXSID0023036
FDA SRS 65M2UDR9AG
Guide to Pharmacology 7599
PubChem 5282375
SureChEMBL SCHEMBL3123
ZINC ZINC000003830820
CONTENTS