PCIDB

KNApSAcK Metabolite C00022268

Metabolite

KNApSAcK Entry

id C00022268
Name Hispanolone
CAS RN 18676-07-8
Standard InChI InChI=1S/C20H30O3/c1-14-16(21)12-17-18(2,3)8-5-9-19(17,4)20(14,22)10-6-15-7-11-23-13-15/h7,11,13-14,17,22H,5-6,8-10,12H2,1-4H3/t14-,17+,19+,20-/m1/s1
Standard InChI (Main Layer) InChI=1S/C20H30O3/c1-14-16(21)12-17-18(2,3)8-5-9-19(17,4)20(14,22)10-6-15-7-11-23-13-15/h7,11,13-14,17,22H,5-6,8-10,12H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1134

Link

ChEMBL

By standard InChI CHEMBL2000054
By standard InChI Main Layer CHEMBL1482813 CHEMBL2000054

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Lamiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ballota hispanica 155229 Lamiaceae asterids Viridiplantae
Leonurus heterophyllus SW. 4137 Lamiaceae asterids Viridiplantae

Human Protein / Gene in interaction

2 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P00352 Retinal dehydrogenase 1 Enzyme CHEMBL1482813 CHEMBL1614458 (1)
0 / 0
P10636 Microtubule-associated protein tau Unclassified protein CHEMBL1482813 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)