PCIDB

KNApSAcK Metabolite C00014304

Metabolite

KNApSAcK Entry

id C00014304
Name Pinocembroside / Pinocembrin 7-O-beta-D-glucoside / (2S)-7-O-beta-D-glucopyranosyl-5-hydroxyflavanone
CAS RN 75829-43-5
Standard InChI InChI=1S/C21H22O9/c22-9-16-18(25)19(26)20(27)21(30-16)28-11-6-12(23)17-13(24)8-14(29-15(17)7-11)10-4-2-1-3-5-10/h1-7,14,16,18-23,25-27H,8-9H2/t14-,16?,18+,19-,20?,21+/m0/s1
Standard InChI (Main Layer) InChI=1S/C21H22O9/c22-9-16-18(25)19(26)20(27)21(30-16)28-11-6-12(23)17-13(24)8-14(29-15(17)7-11)10-4-2-1-3-5-10/h1-7,14,16,18-23,25-27H,8-9H2

Cluster

Phytochemical cluster No. 14
KCF-S cluster No. 12

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1083808

KEGG

By LinkDB

CTD

By CAS RN