PCIDB

KNApSAcK Metabolite C00001457

Metabolite

KNApSAcK Entry

id C00001457
Name Triglochinin
CAS RN 28876-11-1
Standard InChI InChI=1S/C14H17NO10/c15-4-7(6(3-10(19)20)1-2-9(17)18)24-14-13(23)12(22)11(21)8(5-16)25-14/h1-2,8,11-14,16,21-23H,3,5H2,(H,17,18)(H,19,20)/b2-1-,7-6-/t8?,11-,12+,13?,14-/m1/s1
Standard InChI (Main Layer) InChI=1S/C14H17NO10/c15-4-7(6(3-10(19)20)1-2-9(17)18)24-14-13(23)12(22)11(21)8(5-16)25-14/h1-2,8,11-14,16,21-23H,3,5H2,(H,17,18)(H,19,20)

Cluster

Phytochemical cluster No. 72
KCF-S cluster No. 5636

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08342

CTD

By CAS RN C015557