KCF-S cluster No. 178 (34 metabolites)

Corresponding Phytochemical cluster No. 38

• Index
• Plant Species
• KEGG BRITE br08003
• Metabolite list (34)
• Human Protein
  / Gene in interactions
• Related Diseases

Plant Species

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Cumulative plant class count

class name	count
asterids	37
Embryophyta	10
Magnoliophyta	6
Spermatophyta	1

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Cumulative family count

class name	count
Asteraceae	37
Frullaniaceae	5
Scapaniaceae	3
Magnoliaceae	2
Schisandraceae	2
Anastrophyllaceae	2
Cupressaceae	1
Chloranthaceae	1
Lauraceae	1

KEGG BRITE br08003

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Categories (2)

br08003 Category	# of metabolite
Eudesmanes	1
Guaianolide	2

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metabolites link (3)

br08003 Category	KEGG ID	KNApSAcK ID
Eudesmanes	C09454	C00003287
Guaianolide	C09507	C00003328
Guaianolide	C09534	C00003355

Metabolite list (34)

KNApSAcK ID	name	ChEMBL link	CTD link	# of proteins in ChEMBL interaction / related OMIM / related KEGG DISEASE	# of genes in CTD interaction / related diseases	figure
C00003287	(-)-Frullanolide / Tournefortiolide / [3aS-(3aalpha,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		C007787
C00003328	Micheliolide	CHEMBL449579
C00003355	Pseudoivalin
C00012881	1-Deoxyivangustin / Alloalantolactone / [3aR-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one	CHEMBL2332655
C00012882	Dihydroxyalloalantolactone / [3aR-(3aalpha,6alpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-6-hydroxy-5-(hydroxymethyl)-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
C00012885	Diplophyllin / (-)-Diplophyllin / [3aS-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one	CHEMBL2332655
C00012887	Asterolide / Atractylenolide II / [4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one	CHEMBL485805		4 / 0 / 1
C00012888	8-Epiasterolide / [4aS-(4aalpha,8abeta,9aalpha)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one	CHEMBL485805		4 / 0 / 1
C00012911	Ivangustin
C00012928	[3aR-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5-(hydroxymethyl)-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
C00012930	Isoinunal / [3aR-(3aalpha,8abeta,9aalpha)]-2,3,3a,4,6,7,8,8a,9,9a-Decahydro-8a-methyl-3-methylene-2-oxonaphtho[2,3-b]furan-5-carboxaldehyde
C00012960	Armefolin / (+)-Armefolin / [3aS-(3aalpha,5abeta,6beta,8alpha,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6,8-dihydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
C00013031	(+)-Frullanolide / [3aR-(3aalpha,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
C00013038	Splendolide / Magnolialide / [3aS-(3aalpha,5abeta,6beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
C00013039	[3aS-(3aalpha,5aalpha,6alpha,9balpha)]- 3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
C00013042	2alpha-Hydroxysphaerantholide / [3aS-(3aalpha,5abeta,7alpha,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-7-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
C00013047	9beta-Hydroxytournefortiolide / [3aS-(3aalpha,5beta,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-5-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
C00013056	Rothin A / [3aR-(3aalpha,4alpha,5abeta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-4-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
C00020709	Osmitopsin
C00020726	10beta-Hydroxycichopumilide
C00020907	Columellarin
C00020923	[3aR-(3aalpha,4aalpha,5alpha,9abeta)]-3a,4,4a,5,6,7,9,9a-Octahydro-5-hydroxy-5,8-dimethyl-3-methylene-azuleno[6,5-b]furan-2(3H)-one
C00021014	3alpha-Hydroxy-desoxo-achalensolide
C00021015	3alpha-Methoxy-desoxo-achalensolide
C00021016	3beta-Hydroxy-desoxo-achalensolide
C00021017	3beta-Methoxy-desoxo-achalensolide
C00021019	3-Desoxo-achalensolide
C00021101	[3aR-(3aalpha,6alpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-6-hydroxy-5,8a-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one
C00021419	Fastigiolide / Hercynolactone
C00021697	8-epi-Ivangustin
C00022674	14-Hydroxy-desoxyivangustin
C00038337	9alpha-Hydroxyasterolide	CHEMBL454453
C00039369	Henridilactone B
C00044955	Neolitacumone B / (+)-Neolitacumone B

Human Protein / Gene in interactions

4 ChEMBL Protein in interactions

accession	description	class description	KNApSAcK metabolite in interactions	# of diseases (OMIM / KEGG)
P09917	Arachidonate 5-lipoxygenase	Oxidoreductase	C00012887 C00012888	0 / 0
P23219	Prostaglandin G/H synthase 1	Oxidoreductase	C00012887 C00012888	0 / 0
P06401	Progesterone receptor	NR3C3	C00012887 C00012888	0 / 1
Q96RI1	Bile acid receptor	NR1H4	C00012887 C00012888	0 / 0

Related Diseases

Diseases related to proteins in ChEMBL interactions