guttiferone F (CHEBI:65991)

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CHEBI:65991 - guttiferone F

ChEBI ID	CHEBI:65991
ChEBI Name	guttiferone F
Stars
Definition	A member of the class of benzophenones isolated from the stem bark of Allanblackia stuhlmannii and has been shown to exhibit antileishmanial and anticholinesterase activity.
Last Modified	18 February 2013
Downloads	Molfile

Formula	C38H50O6
Net Charge	0
Average Mass	602.812
Monoisotopic Mass	602.36074
SMILES	C=C(C)[C@H](CC=C(C)C)C[C@@]12C[C@@H](CC=C(C)C)C(C)(C)[C@@](CC=C(C)C)(C(=O)C(C(=O)c3ccc(O)c(O)c3)=C1O)C2=O
InChI	InChI=1S/C38H50O6/c1-22(2)11-13-27(25(7)8)20-37-21-28(15-12-23(3)4)36(9,10)38(35(37)44,18-17-24(5)6)34(43)31(33(37)42)32(41)26-14-16-29(39)30(40)19-26/h11-12,14,16-17,19,27-28,39-40,42H,7,13,15,18,20-21H2,1-6,8-10H3/t27-,28-,37-,38+/m1/s1
InChIKey	QDKLRKZQSOQWJQ-LPEHXNHASA-N

Species of Metabolite	Component	Source	Comments
Allanblackia stuhlmannii (IPNI:427050-1)	xylem (BTO:0001468)	PubMed (9917299)	Previous component: root wood;

Roles Classification

Biological Roles:

antileishmanial agent An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania.

apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

EC 3.1.1.8 (cholinesterase) inhibitor An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of cholinesterase (EC 3.1.1.8).

Application:

antileishmanial agent An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania.

ChEBI Ontology

Outgoing Relation(s)
	guttiferone F (CHEBI:65991) has role antileishmanial agent (CHEBI:70868)
	guttiferone F (CHEBI:65991) has role apoptosis inducer (CHEBI:68495)
	guttiferone F (CHEBI:65991) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
	guttiferone F (CHEBI:65991) has role metabolite (CHEBI:25212)
	guttiferone F (CHEBI:65991) is a benzophenones (CHEBI:22726)
	guttiferone F (CHEBI:65991) is a bridged compound (CHEBI:35990)
	guttiferone F (CHEBI:65991) is a polyphenol (CHEBI:26195)

IUPAC Name
(1R,5R,7R)-3-(3,4-dihydroxybenzoyl)-4-hydroxy-8,8-dimethyl-1,7-bis(3-methylbut-2-en-1-yl)-5-[(2R)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]bicyclo[3.3.1]non-3-ene-2,9-dione

Manual Xrefs	Databases
10282668	ChemSpider

Registry Numbers	Sources
Reaxys:4731414	Reaxys

Citations