PCIDB

KNApSAcK Metabolite C00000918

Index

Metabolite

Species

Human Protein
/ Gene in interactions

Related Diseases

Metabolite

KNApSAcK Entry

id	C00000918
Name	Astaxanthin / (3S,3'S)-3,3'-Dihydroxy-beta,beta-carotene-4,4'-dione
CAS RN	472-61-7
Standard InChI	InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-/m0/s1
Standard InChI (Main Layer)	InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3

Cluster

Phytochemical cluster	No. 59
KCF-S cluster	No. 26

Link

ChEMBL

By standard InChI
By standard InChI Main Layer	CHEMBL445751 CHEMBL1358053

KEGG

By LinkDB	C08580

CTD

By CAS RN	C005948

Species

Summary

Plant class

class name	count
eudicotyledons	3

Family

family name	count
Ranunculaceae	2
Amblycipitidae	1
Alcaligenaceae	1
Rhizobiaceae	1
Bagridae	1
Amaranthaceae	1

List (7)

* NCBI

KNApSAcK organism	*ID	*family	*plant class	*kingdom
Adonis aestivalis	113211	Ranunculaceae	eudicotyledons	Viridiplantae
Adonis vernalis	46985	Ranunculaceae	eudicotyledons	Viridiplantae
Agrobacterium aurantiacum	44155	Rhizobiaceae		Bacteria
Alcaligenes PC1	507	Alcaligenaceae		Bacteria
Liobagrus reinii	78875	Amblycipitidae		Metazoa
Pelteobagrus nudiceps	175790	Bagridae		Metazoa
Pfaffia rhodozyma	221784	Amaranthaceae	eudicotyledons	Viridiplantae

Human Protein / Gene in interaction

1 ChEMBL Protein in interactions

accession	description	class description	compound	assay ID (# of activities)	# of diseases (OMIM / KEGG)
P10636	Microtubule-associated protein tau	Unclassified protein	CHEMBL1358053	CHEMBL1614421 (1)	4 / 3

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (4)

OMIM	preferred title	UniProt
#600274	Frontotemporal dementia; ftd	P10636
#260540	Parkinson-dementia syndrome	P10636
#172700	Pick disease of brain	P10636
#601104	Supranuclear palsy, progressive, 1; psnp1	P10636

KEGG DISEASE (3)

KEGG	disease name	UniProt
H00058	Amyotrophic lateral sclerosis (ALS)	P10636 (related)
H00077	Progressive supranuclear palsy (PSP)	P10636 (related)
H00078	Frontotemporal lobar degeneration (FTLD)	P10636 (related)

Diseases related to CTD interactions

7 disease from interactions of metabolites

MeSH disease	OMIM	compound	disease name	evidence type	reference pmid
D000230		C005948	Adenocarcinoma	therapeutic	21621527
D003092		C005948	Colitis	therapeutic	21621527
D003110		C005948	Colonic Neoplasms	therapeutic	21621527
D003921		C005948	Diabetes Mellitus, Experimental	therapeutic	20513374
D003924		C005948	Diabetes Mellitus, Type 2	therapeutic	16964424
D008114		C005948	Liver Neoplasms, Experimental	therapeutic	20038455
D015427		C005948	Reperfusion Injury	therapeutic	19900500