PCIDB

KNApSAcK Metabolite C00003652

Metabolite

KNApSAcK Entry

id C00003652
Name Ergosterol / Ergosta-5,7,22-trien-3beta-ol
CAS RN 57-87-4
Standard InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+/t19-,20+,22-,24+,25-,26-,27-,28+/m0/s1
Standard InChI (Main Layer) InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 111

Link

ChEMBL

By standard InChI CHEMBL1232562
By standard InChI Main Layer CHEMBL222608 CHEMBL1232562 CHEMBL1512075 CHEMBL1741735 CHEMBL1965225

KEGG

By LinkDB C01694

CTD

By CAS RN D004875

Species

Summary

Plant class

class name count
Embryophyta 1

Family (Top 10)

family name count
Coriolaceae 12
Ganodermataceae 6
Pleosporaceae 4
Boletaceae 4
Aspergillaceae 4
Polyporaceae 3
Russulaceae 3
Tricholomataceae 3
Hymenochaetaceae 3
Nectriaceae 3

List (101)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Agaricus campestris 56157 Agaricaceae Fungi
Alternaria alternata 5599 Pleosporaceae Fungi
Alternaria brassicicola 29001 Pleosporaceae Fungi
Alternaria kikuchiana 1232598 Pleosporaceae Fungi
Alternaria tenuis 509205 Pleosporaceae Fungi
Amanita caesarea 67695 Amanitaceae Fungi
Amelaria mellea
Amoebidium parasiticum 4881 Amoebidiaceae Eukaryota
Aspergillus niger 5061 Aspergillaceae Fungi
Aspergillus oryzae IFO 4290 5052 Aspergillaceae Fungi
Boletus luridus 121041 Boletaceae Fungi
Boletus spp. 5369 Boletaceae Fungi
Candida albicans 5476 Fungi
Candida gulliermondii 5475 Fungi
Candida sp. 5475 Fungi
Candida tropicalis 5482 Fungi
Candida utilis 4903 Phaffomycetaceae Fungi
Cantharellus cibarius 36066 Cantharellaceae Fungi
Cladosporium sp. 5498 Davidiellaceae Fungi
Coprinus atramentarius 71694 Psathyrellaceae Fungi
Coriolus pargamenus 5326 Coriolaceae Fungi
Coriolus sangamenus 5326 Coriolaceae Fungi
Coriolus versicolor 5325 Coriolaceae Fungi
Cryptoderma citrinum
Cyathus helenae 380658 Nidulariaceae Fungi
Dictyuchus monosporus 120407 Saprolegniaceae Eukaryota
Emericella rugulosa 41736 Aspergillaceae Fungi
Emericella variecolor 41726 Aspergillaceae Fungi
Flammulina velutipes 38945 Physalacriaceae Fungi
Fomes allardii 40441 Coriolaceae Fungi
Fomes annosus 40441 Coriolaceae Fungi
Fomitopsis cytisina 34474 Coriolaceae Fungi
Fomitopsis pinicola 40483 Coriolaceae Fungi
Fomitopsis pubertatis 34474 Coriolaceae Fungi
Fusarium sporotrichioides 5514 Nectriaceae Fungi
Ganoderma applanatum 29884 Ganodermataceae Fungi
Ganoderma australe 34457 Ganodermataceae Fungi
Ganoderma colossum (FR.) C.F.BAKER 5314 Ganodermataceae Fungi
Ganoderma liplanatum 5314 Ganodermataceae Fungi
Ganoderma lipsiense 101938 Ganodermataceae Fungi
Ganoderma lucidum 5315 Ganodermataceae Fungi
Geotrichum flavo-brunneum 43987 Dipodascaceae Fungi
Gibberella fujikuroi 5127 Nectriaceae Fungi
Gloephyllum sepiarium
Glomus mosseae 27381 Glomeraceae Fungi
Gnomonia leptostyla 187235 Gnomoniaceae Fungi
Grifola frondosa 5627 Schizophyllaceae Fungi
Grifola umbellata 152678 Schizophyllaceae Fungi
Hemispora stellata
Hygrocybe punicea 557324 Hygrophoraceae Fungi
Inocybe macrosperma 71953 Fungi
Lampteromyces japonicus 72119 Omphalotaceae Fungi
Leccinum aurantiacum 121046 Boletaceae Fungi
Leccinum spp. 80654 Boletaceae Fungi
Lentinus edodes 5353 Marasmiaceae Fungi
Lentinus lepideus 38799 Gloeophyllaceae Fungi
Lenzites trabea 5631 Coriolaceae Fungi
Leptosphaeria typhae 5021 Leptosphaeriaceae Fungi
Leucopaxillus giganteus 1167592 Tricholomataceae Fungi
Lobaria pulmonaria 86794 Lobariaceae Fungi
Lobaria scobiculata 63752 Lobariaceae Fungi
Microporous flabelliformis
Monascus pilosus BCRC38072 147546 Elaphomycetaceae Fungi
Monilinia fructigena 38457 Sclerotiniaceae Fungi
Mucor pusillus 4840 Lichtheimiaceae Fungi
Nectria galligena 56674 Nectriaceae Fungi
Neurospora crassa 5141 Sordariaceae Fungi
Panellus serotinus (PERS.:FR.) KUHN. 5635 Tricholomataceae Fungi
Parmelia caperata 87260 Parmeliaceae Fungi
Phellinus gilvus 40471 Hymenochaetaceae Fungi
Phellinus igniarius 40472 Hymenochaetaceae Fungi
Phellinus robustus 89466 Hymenochaetaceae Fungi
Pholiota aegerita 13205 Strophariaceae Fungi
Phycomyces blakesleeanus 4837 Phycomycetaceae Fungi
Pichia sp. 4925 Pichiaceae Fungi
Pleurocybella porrigens 71910 Tricholomataceae Fungi
Polyporus cretaceous 5637 Polyporaceae Fungi
Polyporus dryadeus 5637 Polyporaceae Fungi
Polyporus versicolor 5637 Polyporaceae Fungi
Polytrichum commune 3213 Polytrichaceae Embryophyta Viridiplantae
Poria cocos 81056 Coriolaceae Fungi
Rhizopus arrhizus 64495 Rhizopodaceae Fungi
Russula foetens 131541 Russulaceae Fungi
Russula nigricans 152964 Russulaceae Fungi
Russula senecis 654492 Russulaceae Fungi
Saccharomyces cerevisiae 4932 Saccharomycetaceae Fungi
Scleroderma aurantium 857202 Sclerodermataceae Fungi
Sclerotinia fructicola 5179 Sclerotiniaceae Fungi
Smittium sp.
Spicaria elegans 509241 Clavicipitaceae Fungi
Spongiporus leucomallellus (Murril)
Strachybotrys atra
Suillus bovinus 48563 Suillaceae Fungi
Suillus variegatus 48592 Suillaceae Fungi
Torulopsis glabrata 5478 Saccharomycetaceae Fungi
Trametes feei 5324 Coriolaceae Fungi
Trametes lilacino-gilva 5324 Coriolaceae Fungi
Usnea longissima 143883 Parmeliaceae Fungi
Ustilago maydis 5270 Ustilaginaceae Fungi
Ustilago nuda 86802 Ustilaginaceae Fungi
Xanthoria parietina 107463 Teloschistaceae Fungi

Human Protein / Gene in interaction

12 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P10635 Cytochrome P450 2D6 Cytochrome P450 2D6 CHEMBL1741735 CHEMBL1741321 (1)
1 / 0
P11712 Cytochrome P450 2C9 Cytochrome P450 2C9 CHEMBL1741735 CHEMBL1741325 (1)
0 / 1
P11473 Vitamin D3 receptor NR1I1 CHEMBL1512075 CHEMBL1794311 (1)
2 / 3
P00352 Retinal dehydrogenase 1 Enzyme CHEMBL1512075 CHEMBL1614458 (1)
0 / 0
O94782 Ubiquitin carboxyl-terminal hydrolase 1 Enzyme CHEMBL1512075 CHEMBL1794467 (1)
0 / 0
P05177 Cytochrome P450 1A2 Cytochrome P450 1A2 CHEMBL1741735 CHEMBL1741322 (1)
0 / 0
P16050 Arachidonate 15-lipoxygenase Enzyme CHEMBL1512075 CHEMBL1614240 (1)
0 / 0
P33261 Cytochrome P450 2C19 Cytochrome P450 2C19 CHEMBL1741735 CHEMBL1741323 (1)
1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL1741735 CHEMBL1741324 (1)
0 / 1
P22309 UDP-glucuronosyltransferase 1-1 Enzyme CHEMBL1232562 CHEMBL1908080 (1)
5 / 1
P10636 Microtubule-associated protein tau Unclassified protein CHEMBL1512075 CHEMBL1614421 (1)
4 / 3
P31939 Bifunctional purine biosynthesis protein PURH Enzyme CHEMBL222608 CHEMBL914875 (1)
1 / 1

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (14)

OMIM preferred title UniProt
#608688 Aicar transformylase/imp cyclohydrolase deficiency P31939
#601816 Bilirubin, serum level of, quantitative trait locus 1; biliqtl1 P22309
#218800 Crigler-najjar syndrome, type i P22309
#606785 Crigler-najjar syndrome, type ii P22309
#609535 Drug metabolism, poor, cyp2c19-related P33261
#608902 Drug metabolism, poor, cyp2d6-related P10635
#600274 Frontotemporal dementia; ftd P10636
#143500 Gilbert syndrome P22309
#237900 Hyperbilirubinemia, transient familial neonatal; hblrtfn P22309
#607948 Mycobacterium tuberculosis, susceptibility to P11473
#260540 Parkinson-dementia syndrome P10636
#172700 Pick disease of brain P10636
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636
#277440 Vitamin d-dependent rickets, type 2a; vddr2a P11473

KEGG DISEASE (11)

KEGG disease name UniProt
H00036 Osteosarcoma P08684 (marker)
H00058 Amyotrophic lateral sclerosis (ALS) P10636 (related)
H00077 Progressive supranuclear palsy (PSP) P10636 (related)
H00078 Frontotemporal lobar degeneration (FTLD) P10636 (related)
H00342 Tuberculosis P11473 (related)
H00784 Localized autosomal recessive hypotrichosis P11473 (related)
H01143 Vitamin D-dependent rickets P11473 (related)
H01205 Coumarin resistance P11712 (related)
H00208 Hyperbilirubinemia P22309 (related)
H00966 AICA-ribosiduria P31939 (related)
H01171 Poor drug metabolism (PM) P33261 (related)