PCIDB

KNApSAcK Metabolite C00031656

Metabolite

KNApSAcK Entry

id C00031656
Name Cassialoin
CAS RN 60462-09-1
Standard InChI InChI=1S/C21H22O9/c1-8-5-10-15(12(24)6-8)17(26)14-9(3-2-4-11(14)23)21(10,29)20-19(28)18(27)16(25)13(7-22)30-20/h2-6,13,16,18-20,22-25,27-29H,7H2,1H3
Standard InChI (Main Layer) InChI=1S/C21H22O9/c1-8-5-10-15(12(24)6-8)17(26)14-9(3-2-4-11(14)23)21(10,29)20-19(28)18(27)16(25)13(7-22)30-20/h2-6,13,16,18-20,22-25,27-29H,7H2,1H3

Cluster

Phytochemical cluster No. 61
KCF-S cluster No. 826

Link

ChEMBL

By standard InChI CHEMBL1721715
By standard InChI Main Layer CHEMBL1721715

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Polygonaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Rheum emodi 284363 Polygonaceae eudicotyledons 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 CHEMBL1721715 CHEMBL2114780 (1)
0 / 0
Q96KQ7 Histone-lysine N-methyltransferase EHMT2 Enzyme CHEMBL1721715 CHEMBL1738442 (1)
0 / 0