PCIDB

KNApSAcK Metabolite C00000313

Metabolite

KNApSAcK Entry

id C00000313
Name Xanthinin
CAS RN 580-49-4
Standard InChI InChI=1S/C17H22O5/c1-9-7-15-14(11(3)17(20)22-15)6-5-13(9)16(8-10(2)18)21-12(4)19/h5,9,14-16H,3,6-8H2,1-2,4H3
Standard InChI (Main Layer) InChI=1S/C17H22O5/c1-9-7-15-14(11(3)17(20)22-15)6-5-13(9)16(8-10(2)18)21-12(4)19/h5,9,14-16H,3,6-8H2,1-2,4H3

Cluster

Phytochemical cluster No. 38
KCF-S cluster No. 1750

Link

ChEMBL

By standard InChI CHEMBL1982362
By standard InChI Main Layer CHEMBL1982362

KEGG

By LinkDB C09602

CTD

By CAS RN C022185