PCIDB

KNApSAcK Metabolite C00022287

Metabolite

KNApSAcK Entry

id C00022287
Name Ballonigrin / Ballonigrine
CAS RN 62340-62-9
Standard InChI InChI=1S/C20H24O4/c1-12-14(6-5-13-7-10-23-11-13)19(2)8-4-9-20(3)17(19)16(15(12)21)24-18(20)22/h7,10-11,16-17H,4-6,8-9H2,1-3H3/t16-,17-,19-,20+/m1/s1
Standard InChI (Main Layer) InChI=1S/C20H24O4/c1-12-14(6-5-13-7-10-23-11-13)19(2)8-4-9-20(3)17(19)16(15(12)21)24-18(20)22/h7,10-11,16-17H,4-6,8-9H2,1-3H3

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