Metabolite

KNApSAcK Entry

id C00001469
Name Glucoconringiin / 2-Hydroxy-2-methylpropyl glucosinolate
CAS RN 28463-28-7
Standard InChI InChI=1S/C11H21NO10S2/c1-11(2,17)3-6(12-22-24(18,19)20)23-10-9(16)8(15)7(14)5(4-13)21-10/h5,7-10,13-17H,3-4H2,1-2H3,(H,18,19,20)/b12-6-/t5?,7-,8?,9+,10+/m0/s1
Standard InChI (Main Layer) InChI=1S/C11H21NO10S2/c1-11(2,17)3-6(12-22-24(18,19)20)23-10-9(16)8(15)7(14)5(4-13)21-10/h5,7-10,13-17H,3-4H2,1-2H3,(H,18,19,20)

Cluster

Phytochemical cluster No. 76
KCF-S cluster No. 46

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08408

CTD

By CAS RN