PCIDB

KNApSAcK Metabolite C00022288

Metabolite

KNApSAcK Entry

id C00022288
Name Ballonigrinone
CAS RN 62340-63-0
Standard InChI InChI=1S/C20H22O5/c1-11-13(5-4-12-7-9-24-10-12)19(2)8-6-14(21)20(3)17(19)16(15(11)22)25-18(20)23/h7,9-10,16-17H,4-6,8H2,1-3H3/t16-,17-,19-,20+/m1/s1
Standard InChI (Main Layer) InChI=1S/C20H22O5/c1-11-13(5-4-12-7-9-24-10-12)19(2)8-6-14(21)20(3)17(19)16(15(11)22)25-18(20)23/h7,9-10,16-17H,4-6,8H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2648

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ballota rupestris 155228 Lamiaceae asterids Viridiplantae