CHEBI:42471 - forskolin

ChEBI IDCHEBI:42471
ChEBI Nameforskolin
Stars
DefinitionA labdane diterpenoid isolated from the Indian Coleus plant.
Last Modified10 November 2020
DownloadsMolfile
FormulaC22H34O7
Net Charge0
Average Mass410.507
Monoisotopic Mass410.23045
SMILES[H][C@@]12[C@H](O)[C@H](OC(C)=O)[C@@]3(C)O[C@@](C)(C=C)CC(=O)[C@]3(O)[C@@]1(C)[C@@H](O)CCC2(C)C
InChIInChI=1S/C22H34O7/c1-8-19(5)11-14(25)22(27)20(6)13(24)9-10-18(3,4)16(20)15(26)17(28-12(2)23)21(22,7)29-19/h8,13,15-17,24,26-27H,1,9-11H2,2-7H3/t13-,15-,16-,17-,19-,20-,21+,22-/m0/s1
InChIKeyOHCQJHSOBUTRHG-KGGHGJDLSA-N
Wikipedia
Roles Classification
Biological Roles:
protein kinase A agonist  A protein kinase agonist that selectively binds to and activates a protein kinase A receptor
anti-HIV agent  An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus.
adenylate cyclase agonist  Any agonist of one or more of the isoforms of adenylate cyclase (EC 4.6.1.1).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Applications:
platelet aggregation inhibitor  A drug or agent which antagonizes or impairs any mechanism leading to blood platelet aggregation, whether during the phases of activation and shape change or following the dense-granule release reaction and stimulation of the prostaglandin-thromboxane system.
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
ChEBI Ontology
Outgoing Relation(s)
forskolin (CHEBI:42471) has role adenylate cyclase agonist (CHEBI:78548)
forskolin (CHEBI:42471) has role anti-HIV agent (CHEBI:64946)
forskolin (CHEBI:42471) has role antihypertensive agent (CHEBI:35674)
forskolin (CHEBI:42471) has role plant metabolite (CHEBI:76924)
forskolin (CHEBI:42471) has role platelet aggregation inhibitor (CHEBI:50427)
forskolin (CHEBI:42471) has role protein kinase A agonist (CHEBI:78547)
forskolin (CHEBI:42471) is a acetate ester (CHEBI:47622)
forskolin (CHEBI:42471) is a cyclic ketone (CHEBI:3992)
forskolin (CHEBI:42471) is a labdane diterpenoid (CHEBI:36770)
forskolin (CHEBI:42471) is a organic heterotricyclic compound (CHEBI:26979)
forskolin (CHEBI:42471) is a tertiary α-hydroxy ketone (CHEBI:139592)
forskolin (CHEBI:42471) is a triol (CHEBI:27136)
Incoming Relation(s)
1,9-dideoxyforskolin (CHEBI:50295) has functional parent forskolin (CHEBI:42471)
colforsin daropate (CHEBI:166826) has functional parent forskolin (CHEBI:42471)
methylpiperazinoforskolin (CHEBI:42430) has functional parent forskolin (CHEBI:42471)
IUPAC Name 
(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxododecahydro-1H-benzo[f]chromen-5-yl acetate
INNs  Source
colforsinChemIDplus
colforsinaChemIDplus
colforsineChemIDplus
colforsinumChemIDplus
Synonyms  Source
7β-acetoxy-8,13-epoxy-1α,6β,9α-trihydroxylabd-14-en-11-oneChemIDplus
ColeonolKEGG COMPOUND
ColeonolkKEGG COMPOUND
ColforsinKEGG COMPOUND
ForskolinKEGG COMPOUND
FORSKOLINPDBeChem
Manual XrefsDatabases
C00003416KNApSAcK
C09076KEGG COMPOUND
D03584KEGG DRUG
DB02587DrugBank
DE2557784Patent
FOKPDBeChem
ForskolinWikipedia
US4088659Patent
US4476140Patent
Registry NumbersSources
Reaxys:4300863Reaxys
CAS:66428-89-5ChemIDplus
CAS:66575-29-9KEGG COMPOUND
CAS:66575-29-9ChemIDplus
Citations