PCIDB

KNApSAcK Metabolite C00025551

Metabolite

KNApSAcK Entry

id C00025551
Name / Acetyltropine / Tropyl acetate / O-Acetyltropine / 3alpha-Acetoxytropane / Tropine acetate (ester) / Tropan-3a-ol acetate (ester) / endo-3-Acetoxy-8-methyl-8-azabicyclo[3.2.1]octane
CAS RN 3423-27-6
Standard InChI InChI=1S/C10H17NO2/c1-7(12)13-10-5-8-3-4-9(6-10)11(8)2/h8-10H,3-6H2,1-2H3/t8-,9+,10+
Standard InChI (Main Layer) InChI=1S/C10H17NO2/c1-7(12)13-10-5-8-3-4-9(6-10)11(8)2/h8-10H,3-6H2,1-2H3

Cluster

Phytochemical cluster No. 1
KCF-S cluster No. 1464

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL193341

KEGG

By LinkDB C12452

CTD

By CAS RN C071887

Species

Summary

Plant class

class name count
asterids 22
rosids 2

Family

family name count
Solanaceae 22
Rhizophoraceae 2

List (24)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Anthotroche myoporoides C.A.Gardn 195723 Solanaceae asterids Viridiplantae
Anthotroche walcottii F.Muell 195723 Solanaceae asterids Viridiplantae
Bruguiera exaristata Ding Hou 106617 Rhizophoraceae rosids Viridiplantae
Bruguiera sexangula (Lour.) poir. 98584 Rhizophoraceae rosids Viridiplantae
Cyphanthera albicans (A.Cunn.) Miers ssp.albicans 195730 Solanaceae asterids Viridiplantae
Datura candida X candida 4074 Solanaceae asterids Viridiplantae
Datura discolor Bernh 4074 Solanaceae asterids Viridiplantae
Datura ferox L. 169103 Solanaceae asterids Viridiplantae
Datura innoxia Mill 4074 Solanaceae asterids Viridiplantae
Datura metel L.var.fastuosa(Bernh.)Danert 4074 Solanaceae asterids Viridiplantae
Datura quercifolia H.B.K. 4074 Solanaceae asterids Viridiplantae
Datura sanguinea R.and P. 4074 Solanaceae asterids Viridiplantae
Datura stramonium L. 4076 Solanaceae asterids Viridiplantae
Datura suaveolens H.and B.ex Willd 4074 Solanaceae asterids Viridiplantae
Datura wrightii Regel 434267 Solanaceae asterids Viridiplantae
Duboisia myoporoides R.Br. 195737 Solanaceae asterids Viridiplantae
Grammosolen dixonii (F.Muell.et R.Tate)Haegi 195738 Solanaceae asterids Viridiplantae
Hyoscyamus albus L. 310458 Solanaceae asterids Viridiplantae
Hyoscyamus desertorum Tackh 4078 Solanaceae asterids Viridiplantae
Hyoscyamus pusillus L. 540805 Solanaceae asterids Viridiplantae
Solandra grandiflora Sw. 33123 Solanaceae asterids Viridiplantae
Solandra guttata D.Don ex Lindley 24680 Solanaceae asterids Viridiplantae
Solandra hirsuta Dun 24680 Solanaceae asterids Viridiplantae
Solandra macrocantha Dun 24680 Solanaceae asterids Viridiplantae

Human Protein / Gene in interaction

5 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P08172 Muscarinic acetylcholine receptor M2 Acetylcholine receptor CHEMBL193341 CHEMBL872169 (1)
2 / 0
P20309 Muscarinic acetylcholine receptor M3 Acetylcholine receptor CHEMBL193341 CHEMBL872169 (1)
1 / 0
P08912 Muscarinic acetylcholine receptor M5 Acetylcholine receptor CHEMBL193341 CHEMBL872169 (1)
0 / 0
P11229 Muscarinic acetylcholine receptor M1 Acetylcholine receptor CHEMBL193341 CHEMBL872169 (1)
0 / 0
P08173 Muscarinic acetylcholine receptor M4 Acetylcholine receptor CHEMBL193341 CHEMBL872169 (1)
0 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (3)

OMIM preferred title UniProt
#100100 Abdominal muscles, absence of, with urinary tract abnormality and cryptorchidism P20309
#103780 Alcohol dependence P08172
#608516 Major depressive disorder; mdd P08172