CHEBI:180901 - Ro 25-6981 maleate

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ChEBI Name Ro 25-6981 maleate
ChEBI ID CHEBI:180901
Definition The maleic acid salt of Ro 25-6981. It is a potent and selective antagonist of GluN2B-containing NMDA receptors.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Stan Laulederkind
Supplier Information
Download Molfile XML SDF
Formula C22H29NO2.C4H4O4
Net Charge 0
Average Mass 455.551
Monoisotopic Mass 455.23079
InChI InChI=1S/C22H29NO2.C4H4O4/c1-17(22(25)20-7-9-21(24)10-8-20)16-23-13-11-19(12-14-23)15-18-5-3-2-4-6-18;5-3(6)1-2-4(7)8/h2-10,17,19,22,24-25H,11-16H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t17-,22+;/m0./s1
InChIKey FYJZEHCQSUBZDY-SEELMCCHSA-N
SMILES OC(=O)\C=C/C(O)=O.C[C@@H](CN1CCC(CC2=CC=CC=C2)CC1)[C@@H](O)C1=CC=C(O)C=C1
Roles Classification
Biological Role(s): NMDA receptor antagonist
Any substance that inhibits the action of N-methyl-D-aspartate (NMDA) receptors. They tend to induce a state known as dissociative anesthesia, marked by catalepsy, amnesia, and analgesia, while side effects can include hallucinations, nightmares, and confusion. Due to their psychotomimetic effects, many NMDA receptor antagonists are used as recreational drugs.
Application(s): anticonvulsant
A drug used to prevent seizures or reduce their severity.
antidepressant
Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
neuroprotective agent
Any compound that can be used for the treatment of neurodegenerative disorders.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ro 25-6981 maleate (CHEBI:180901) has part Ro 25-6981(1+) (CHEBI:183314)
Ro 25-6981 maleate (CHEBI:180901) has role anticonvulsant (CHEBI:35623)
Ro 25-6981 maleate (CHEBI:180901) has role antidepressant (CHEBI:35469)
Ro 25-6981 maleate (CHEBI:180901) has role neuroprotective agent (CHEBI:63726)
Ro 25-6981 maleate (CHEBI:180901) has role NMDA receptor antagonist (CHEBI:60643)
Ro 25-6981 maleate (CHEBI:180901) is a maleate salt (CHEBI:50221)
IUPAC Name
4-[(1R,2S)-3-(4-benzylpiperidin-1-yl)-1-hydroxy-2-methylpropyl]phenol (2Z)-but-2-enedioate
Synonyms Sources
(αR,βS)-α-(4-hydroxyphenyl)-β-methyl-4-(phenylmethyl)-1-piperidinepropanol maleate ChEBI
4-((1R,2S)-3-(4-benzylpiperidin-1-yl)-1-hydroxy-2-methylpropyl)phenol maleate ChEBI
αR-(4-hydroxyphenyl)-βS-methyl-4-(phenylmethyl)-1-piperidinepropanol, 2Z-butenedioate ChEBI
Ro 25-6981 (maleate) ChEBI
Manual Xref Database
21475062 ChemSpider
View more database links
Registry Number Type Source
1312991-76-6 CAS Registry Number ChEBI
Citations Waiting for Citations Types Sources
25446739 PubMed citation Europe PMC
27456026 PubMed citation SUBMITTER
9400004 PubMed citation SUBMITTER
Last Modified
04 November 2021