PCIDB

KNApSAcK Metabolite C00034652

Metabolite

KNApSAcK Entry

id C00034652
Name R1-Barrigenol
CAS RN 15399-43-6
Standard InChI InChI=1S/C30H50O6/c1-25(2)14-17-16-8-9-19-27(5)12-11-20(32)26(3,4)18(27)10-13-28(19,6)29(16,7)22(34)24(36)30(17,15-31)23(35)21(25)33/h8,17-24,31-36H,9-15H2,1-7H3/t17-,18-,19+,20-,21-,22-,23-,24+,27-,28+,29-,30+/m0/s1
Standard InChI (Main Layer) InChI=1S/C30H50O6/c1-25(2)14-17-16-8-9-19-27(5)12-11-20(32)26(3,4)18(27)10-13-28(19,6)29(16,7)22(34)24(36)30(17,15-31)23(35)21(25)33/h8,17-24,31-36H,9-15H2,1-7H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 13

Link

ChEMBL

By standard InChI CHEMBL520888
By standard InChI Main Layer CHEMBL520888 CHEMBL2144007

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1
rosids 1

Family

family name count
Hippocastanaceae 1

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Aesculus pavia L. 43872 Hippocastanaceae rosids Viridiplantae
Barringtonia racemosa 107821 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)
O75496 Geminin Unclassified protein CHEMBL2144007 CHEMBL2114780 (1)
0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor CHEMBL2144007 CHEMBL2114788 (1)
0 / 0