PCIDB

KNApSAcK Metabolite C00003674

Metabolite

KNApSAcK Entry

id C00003674
Name Stigmasterol / beta-Stigmasterol
CAS RN 83-48-7
Standard InChI InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
Standard InChI (Main Layer) InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 53

Link

ChEMBL

By standard InChI CHEMBL400247
By standard InChI Main Layer CHEMBL66943 CHEMBL186373 CHEMBL400247 CHEMBL1568947

KEGG

By LinkDB C05442

CTD

By CAS RN D013265

Species

Summary

Plant class

class name count
rosids 17
asterids 10
Magnoliophyta 2
Liliopsida 1

Family (Top 10)

family name count
Fabaceae 4
Asteraceae 3
Combretaceae 2
Apiaceae 2
Hypericaceae 2
Solanaceae 2
Euphorbiaceae 2
Moraceae 2
Myrtaceae 1
Araliaceae 1

List (30)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Allanblackia monticola Staner L.C 469913 Clusiaceae rosids Viridiplantae
Arabidopsis thaliana 3702 Brassicaceae rosids Viridiplantae
Aristolochia heterophylla Hemsl 12947 Aristolochiaceae Magnoliophyta Viridiplantae
Centrosema pubescens 185703 Fabaceae rosids Viridiplantae
Conyza aegyptica 41552 Asteraceae asterids Viridiplantae
Croton urucurana Baill. 518879 Euphorbiaceae rosids Viridiplantae
Croton zambesicus 323089 Euphorbiaceae rosids Viridiplantae
Eleutherococcus senticosus Rupr.and Maxim. 50304 Araliaceae asterids Viridiplantae
Embelia schimperi 459628 Primulaceae asterids Viridiplantae
Eysenhardtia polystachya 457900 Fabaceae rosids Viridiplantae
Fagara tessmannii Engl. 23513 Rutaceae rosids Viridiplantae
Feijoa sellowiana 260130 Myrtaceae rosids Viridiplantae
Ferula diversivittata 371338 Apiaceae asterids Viridiplantae
Ferula szowitsiana 555415 Apiaceae asterids Viridiplantae
Ficus hirta 309429 Moraceae rosids Viridiplantae
Ficus septica 100573 Moraceae rosids Viridiplantae
Glycine max 3847 Fabaceae rosids Viridiplantae
Hypericum beanii 268979 Hypericaceae rosids Viridiplantae
Inula anatolica 557638 Asteraceae asterids Viridiplantae
Iris soforana 26339 Iridaceae Liliopsida Viridiplantae
Launaea arborescens 43199 Asteraceae asterids Viridiplantae
Nicotiana benthamiana 4100 Solanaceae asterids Viridiplantae
Ouratea sulcata 58891 Ochnaceae rosids Viridiplantae
Physostigma venenosum 271807 Fabaceae rosids Viridiplantae
Piper philippinum 13215 Piperaceae Magnoliophyta Viridiplantae
Pteleopsis hylodendron 507434 Combretaceae rosids Viridiplantae
Sebertia acuminata 280718 Sapotaceae asterids Viridiplantae
Terminalia superba 39992 Combretaceae rosids Viridiplantae
Vismia laurentii 198794 Hypericaceae rosids Viridiplantae
Withania somnifera 126910 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)
P06746 DNA polymerase beta Enzyme CHEMBL400247 CHEMBL921744 (1) CHEMBL921745 (1)
CHEMBL993810 (1)
0 / 0
P34969 5-hydroxytryptamine receptor 7 Serotonin receptor CHEMBL400247 CHEMBL977664 (1)
0 / 0
P09884 DNA polymerase alpha catalytic subunit Transferase CHEMBL186373 CHEMBL830331 (1)
0 / 0
P11388 DNA topoisomerase 2-alpha Isomerase CHEMBL186373 CHEMBL830332 (1)
0 / 0
Q02880 DNA topoisomerase 2-beta Isomerase CHEMBL186373 CHEMBL830332 (1)
0 / 0

CTD interaction (1)

compound gene gene name gene description interaction interaction type form reference
pmid
D013265 10599 SLCO1B1
HBLRR
LST-1
LST1
OATP-C
OATP1B1
OATP2
OATPC
SLC21A6
solute carrier organic anion transporter family, member 1B1 SLCO1B1 SNP results in increased abundance of Stigmasterol increases abundance
SNP 22022402