PCIDB

KNApSAcK Metabolite C00001224

Metabolite

KNApSAcK Entry

id C00001224
Name Linoleic acid / (Z,Z)-9,12-Octadecadienoic acid
CAS RN 60-33-3
Standard InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9+
Standard InChI (Main Layer) InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)

Cluster

Phytochemical cluster No. 68
KCF-S cluster No. 367

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL267476

KEGG

By LinkDB C01595

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 17
asterids 15
Liliopsida 4
eudicotyledons 2

Family (Top 10)

family name count
Boraginaceae 10
Rosaceae 3
Brassicaceae 3
Calophyllaceae 2
Fabaceae 2
Urticaceae 2
Acanthaceae 1
Caryophyllaceae 1
Oleaceae 1
Euphorbiaceae 1

List (43)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Acorus calanus L. 4464 Acoraceae Liliopsida Viridiplantae
Aesculus hippocastanum L. 43363 Hippocastanaceae rosids Viridiplantae
Alpinia oxyphylla 125261 Zingiberaceae Liliopsida Viridiplantae
Aphanamixis polystachya 201010 Meliaceae rosids Viridiplantae
Aspergillus insuetus 469274 Aspergillaceae Fungi
Boehmeria holosericea 83905 Urticaceae rosids Viridiplantae
Boehmeria tricuspis 644073 Urticaceae rosids Viridiplantae
Brassica hirta 3728 Brassicaceae rosids Viridiplantae
Calophyllum calaba 883767 Calophyllaceae rosids Viridiplantae
Calophyllum inophyllum 158927 Calophyllaceae rosids Viridiplantae
Clitoria ternata 43365 Fabaceae rosids Viridiplantae
Drymaria cordata 191453 Caryophyllaceae eudicotyledons Viridiplantae
Echium auberianum 113426 Boraginaceae asterids Viridiplantae
Echium boissieri 21610 Boraginaceae asterids Viridiplantae
Echium gentianoides 173991 Boraginaceae asterids Viridiplantae
Echium giganteum 113433 Boraginaceae asterids Viridiplantae
Echium lusitanicum 113440 Boraginaceae asterids Viridiplantae
Echium pitardii 113445 Boraginaceae asterids Viridiplantae
Echium plantagineum 113446 Boraginaceae asterids Viridiplantae
Echium sabulicola 113448 Boraginaceae asterids Viridiplantae
Echium strictum 113450 Boraginaceae asterids Viridiplantae
Echium vulgare 34253 Boraginaceae asterids Viridiplantae
Erycibe expansa 197385 Convolvulaceae asterids Viridiplantae
Ganoderma lucidum 5315 Ganodermataceae Fungi
Iris soforana 26339 Iridaceae Liliopsida Viridiplantae
Isatis tinctoria 161756 Brassicaceae rosids Viridiplantae
Jasminum auriculatum 4147 Oleaceae asterids Viridiplantae
Jatropha curcus 3995 Euphorbiaceae rosids Viridiplantae
Justicia heterocarpa T.ANDERS 4190 Acanthaceae asterids Viridiplantae
Lepidium meyenii Maca 19205 Brassicaceae rosids Viridiplantae
Mandragora autumnalis 389206 Solanaceae asterids Viridiplantae
Monascus pilosus BCRC38072 147546 Elaphomycetaceae Fungi
Potentilla asiatica 23204 Rosaceae rosids Viridiplantae
Potentilla desertorum 667246 Rosaceae rosids Viridiplantae
Potentilla orientalis 23204 Rosaceae rosids Viridiplantae
Poterium polygamum
Psoralea corylifolia 429560 Fabaceae rosids Viridiplantae
Saxifraga stolonifera Meerb. 3798 Saxifragaceae eudicotyledons Viridiplantae
Silybum marianum 92921 Asteraceae asterids Viridiplantae
Spongiporus leucomallellus (Murril)
Tilia cordata Mill. 172266 Malvaceae rosids Viridiplantae
Tripterygium hypoglaucum 205465 Celastraceae rosids Viridiplantae
Typha domingensis P. 4732 Typhaceae Liliopsida Viridiplantae

Human Protein / Gene in interaction

29 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P35610 Sterol O-acyltransferase 1 Enzyme CHEMBL267476 CHEMBL874435 (1) CHEMBL828068 (1)
0 / 0
P15090 Fatty acid-binding protein, adipocyte Other cytosolic protein CHEMBL267476 CHEMBL1120071 (1) CHEMBL1120072 (1)
CHEMBL1120075 (1)
0 / 0
Q03181 Peroxisome proliferator-activated receptor delta NR1C2 CHEMBL267476 CHEMBL1794552 (1)
0 / 0
P05413 Fatty acid-binding protein, heart Other cytosolic protein CHEMBL267476 CHEMBL1120073 (1)
0 / 0
P02545 Prelamin-A/C Unclassified protein CHEMBL267476 CHEMBL1614544 (1)
11 / 10
P16473 Thyrotropin receptor Glycohormone receptor CHEMBL267476 CHEMBL1614281 (1) CHEMBL1614361 (1)
3 / 2
P19793 Retinoic acid receptor RXR-alpha NR2B1 CHEMBL267476 CHEMBL1794371 (1) CHEMBL1794471 (1)
0 / 0
P51452 Dual specificity protein phosphatase 3 Ser_Thr_Tyr CHEMBL267476 CHEMBL1918613 (1)
0 / 0
P23219 Prostaglandin G/H synthase 1 Oxidoreductase CHEMBL267476 CHEMBL1008496 (1)
0 / 0
P00352 Retinal dehydrogenase 1 Enzyme CHEMBL267476 CHEMBL1614458 (1)
0 / 0
Q92830 Histone acetyltransferase KAT2A Enzyme CHEMBL267476 CHEMBL1738606 (1)
0 / 0
O75496 Geminin Unclassified protein CHEMBL267476 CHEMBL2114843 (1)
0 / 0
Q9UGP5 DNA polymerase lambda Enzyme CHEMBL267476 CHEMBL1921596 (1) CHEMBL1920071 (1)
0 / 0
O94782 Ubiquitin carboxyl-terminal hydrolase 1 Enzyme CHEMBL267476 CHEMBL1794467 (1)
0 / 0
P11511 Cytochrome P450 19A1 Cytochrome P450 19A1 CHEMBL267476 CHEMBL976708 (1) CHEMBL976710 (1)
CHEMBL976711 (1)
2 / 2
P37231 Peroxisome proliferator-activated receptor gamma NR1C3 CHEMBL267476 CHEMBL1027138 (1) CHEMBL1794293 (2)
CHEMBL1794510 (1)
5 / 3
P13726 Tissue factor Membrane receptor CHEMBL267476 CHEMBL995691 (1)
0 / 0
Q96RI1 Bile acid receptor NR1H4 CHEMBL267476 CHEMBL1794437 (1)
0 / 0
P35236 Tyrosine-protein phosphatase non-receptor type 7 Tyr CHEMBL267476 CHEMBL1918616 (1)
0 / 0
Q99714 3-hydroxyacyl-CoA dehydrogenase type-2 Enzyme CHEMBL267476 CHEMBL1613910 (1)
3 / 3
P15428 15-hydroxyprostaglandin dehydrogenase [NAD(+)] Enzyme CHEMBL267476 CHEMBL1614038 (1)
2 / 2
P03372 Estrogen receptor NR3A1 CHEMBL267476 CHEMBL1794542 (1) CHEMBL1941568 (1)
CHEMBL1941569 (1)
1 / 1
P16050 Arachidonate 15-lipoxygenase Enzyme CHEMBL267476 CHEMBL1614240 (1)
0 / 0
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL267476 CHEMBL1614108 (1) CHEMBL1613886 (1)
0 / 1
O14842 Free fatty acid receptor 1 Free fatty acid receptor CHEMBL267476 CHEMBL943674 (1) CHEMBL943677 (1)
CHEMBL943678 (1) CHEMBL946731 (1)
CHEMBL946732 (2)
0 / 0
P10275 Androgen receptor NR3C4 CHEMBL267476 CHEMBL1794560 (1)
3 / 4
Q07869 Peroxisome proliferator-activated receptor alpha NR1C1 CHEMBL267476 CHEMBL2114915 (2)
0 / 0
Q9UBT6 DNA polymerase kappa Enzyme CHEMBL267476 CHEMBL1794536 (1) CHEMBL1921592 (1)
CHEMBL1921595 (1)
0 / 0
Q9NUW8 Tyrosyl-DNA phosphodiesterase 1 Enzyme CHEMBL267476 CHEMBL1614364 (1)
1 / 1

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (31)

OMIM preferred title UniProt
#300438 17-beta-hydroxysteroid dehydrogenase x deficiency Q99714
#300068 Androgen insensitivity syndrome; ais P10275
#312300 Androgen insensitivity, partial; pais P10275
#613546 Aromatase deficiency P11511
#139300 Aromatase excess syndrome; aexs P11511
%606641 Body mass index; bmi P37231
#115200 Cardiomyopathy, dilated, 1a; cmd1a P02545
#212112 Cardiomyopathy, dilated, with hypergonadotropic hypogonadism P02545
#609338 Carotid intimal medial thickness 1 P37231
#605588 Charcot-marie-tooth disease, axonal, type 2b1; cmt2b1 P02545
#119900 Digital clubbing, isolated congenital P15428
#181350 Emery-dreifuss muscular dystrophy 2, autosomal dominant; edmd2 P02545
#615363 Estrogen resistance; estrr P03372
#137800 Glioma susceptibility 1; glm1 P37231
#610140 Heart-hand syndrome, slovenian type P02545
#176670 Hutchinson-gilford progeria syndrome; hgps P02545
#603373 Hyperthyroidism, familial gestational P16473
#609152 Hyperthyroidism, nonautoimmune P16473
#259100 Hypertrophic osteoarthropathy, primary, autosomal recessive, 1; phoar1 P15428
#275200 Hypothyroidism, congenital, nongoitrous, 1; chng1 P16473
#151660 Lipodystrophy, familial partial, type 2; fpld2 P02545
#604367 Lipodystrophy, familial partial, type 3; fpld3 P37231
#248370 Mandibuloacral dysplasia with type a lipodystrophy; mada P02545
#300705 Mental retardation, x-linked 17; mrx17 Q99714
#300220 Mental retardation, x-linked, syndromic 10; mrxs10 Q99714
#613205 Muscular dystrophy, congenital, lmna-related P02545
#159001 Muscular dystrophy, limb-girdle, type 1b; lgmd1b P02545
#601665 Obesity P37231
#275210 Restrictive dermopathy, lethal P02545
#313200 Spinal and bulbar muscular atrophy, x-linked 1; smax1 P10275
#607250 Spinocerebellar ataxia, autosomal recessive, with axonal neuropathy; scan1 Q9NUW8

KEGG DISEASE (28)

KEGG disease name UniProt
H00264 Charcot-Marie-Tooth disease (CMT) P02545 (related)
H00294 Dilated cardiomyopathy (DCM) P02545 (related)
H00420 Familial partial lipodystrophy (FPL) P02545 (related)
P37231 (related)
H00563 Emery-Dreifuss muscular dystrophy P02545 (related)
H00590 Congenital muscular dystrophies (CMD/MDC) P02545 (related)
H00593 Limb-girdle muscular dystrophy (LGMD) P02545 (related)
H00601 Hutchinson-Gilford progeria syndrome P02545 (related)
H00663 Restrictive dermopathy P02545 (related)
H00665 Mandibuloacral dysplasia P02545 (related)
H01216 Left ventricular noncompaction (LVNC) P02545 (related)
H00026 Endometrial Cancer P03372 (marker)
H00036 Osteosarcoma P08684 (marker)
H00024 Prostate cancer P10275 (related)
H00062 Spinal and bulbar muscular atrophy (SBMA) P10275 (related)
H00608 46,XY disorders of sex development (Disorders in androgen synthesis or action) P10275 (related)
H00609 46,XY disorders of sex development (Other) P10275 (related)
H00599 46,XX disorders of sex development (Disorders related to androgen excess) P11511 (related)
H00794 Aromatase excess syndrome P11511 (related)
H00457 Primary hypertrophic osteoarthropathy (PHO) P15428 (related)
H01246 Isolated congenital nail clubbing (ICNC) P15428 (related)
H00250 Congenital nongoitrous hypothyroidism (CHNG) P16473 (related)
H01269 Congenital hyperthyroidism P16473 (related)
H00032 Thyroid cancer P37231 (related)
H00409 Type II diabetes mellitus P37231 (related)
H00480 Non-syndromic X-linked mental retardation Q99714 (related)
H00658 Syndromic X-linked mental retardation Q99714 (related)
H00925 2-Methyl-3-hydroxybutyryl-CoA dehydrogenase (MHBD) deficiency Q99714 (related)
H00063 Spinocerebellar ataxia (SCA) Q9NUW8 (related)