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CHEBI:168676 - 7-hydroxyolanzapine

ChEBI IDCHEBI:168676
ChEBI Name7-hydroxyolanzapine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20N4OS
Net Charge0
Average Mass328.441
Monoisotopic Mass328.13578
SMILESCc1cc2c(s1)Nc1ccc(O)cc1N=C2N1CCN(C)CC1
InChIInChI=1S/C17H20N4OS/c1-11-9-13-16(21-7-5-20(2)6-8-21)18-15-10-12(22)3-4-14(15)19-17(13)23-11/h3-4,9-10,19,22H,5-8H2,1-2H3
InChIKeySMNUCABXNXAPBY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Biological Role:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
Application:
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
ChEBI Ontology
Outgoing Relation(s)
7-hydroxyolanzapine (CHEBI:168676) is a benzodiazepine (CHEBI:22720)
IUPAC Name 
2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]benzodiazepin-7-ol
Manual XrefsDatabases
HMDB0060958HMDB
30778613ChemSpider