CHEBI:156296 - G-1

ChEBI IDCHEBI:156296
ChEBI NameG-1
Stars
DefinitionAn organic heterotricyclic compound that is 3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline substituted by 6-bromo-1,3-benzodioxol-5-yl and acetyl groups at positions 4 and 8, respectively (the 3aS,4R,9bR-stereoisomer). It is a potent and selective GPER1 agonist (Ki = 11 nM).
Last Modified10 September 2024
Submittersabrina, zfin
DownloadsMolfile
FormulaC21H18BrNO3
Net Charge0
Average Mass412.283
Monoisotopic Mass411.04701
SMILES[H][C@@]12C=CC[C@]1([H])[C@H](c1cc3c(cc1Br)OCO3)Nc1ccc(C(C)=O)cc12
InChIInChI=1S/C21H18BrNO3/c1-11(24)12-5-6-18-15(7-12)13-3-2-4-14(13)21(23-18)16-8-19-20(9-17(16)22)26-10-25-19/h2-3,5-9,13-14,21,23H,4,10H2,1H3/t13-,14+,21-/m1/s1
InChIKeyVHSVKVWHYFBIFJ-HKZYLEAXSA-N
Roles Classification
Biological Roles:
G-protein-coupled receptor agonist  An agonist that binds to and activates G-protein-coupled receptors
microtubule-destabilising agent  Any substance that interacts with tubulin to inhibit polymerisation of microtubules.
anti-obesity agent  Any substance which is used to reduce or control weight.
Applications:
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
G-1 (CHEBI:156296) has role anti-obesity agent (CHEBI:74518)
G-1 (CHEBI:156296) has role antihypertensive agent (CHEBI:35674)
G-1 (CHEBI:156296) has role antineoplastic agent (CHEBI:35610)
G-1 (CHEBI:156296) has role G-protein-coupled receptor agonist (CHEBI:70998)
G-1 (CHEBI:156296) has role microtubule-destabilising agent (CHEBI:61951)
G-1 (CHEBI:156296) is a aromatic ketone (CHEBI:76224)
G-1 (CHEBI:156296) is a benzodioxole (CHEBI:38733)
G-1 (CHEBI:156296) is a methyl ketone (CHEBI:51867)
G-1 (CHEBI:156296) is a organic heterotricyclic compound (CHEBI:26979)
G-1 (CHEBI:156296) is a organobromine compound (CHEBI:37141)
IUPAC Name 
1-[(3aS,4R,9bR)-4-(6-bromo-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]ethanone
Synonyms  Source
G 1ChEBI
G1ChEBI
Registry NumbersSources
CAS:881639-98-1SUBMITTER
Citations