PCIDB

KNApSAcK Metabolite C00027263

Metabolite

KNApSAcK Entry

id C00027263
Name 6-Acetonyldihydroavicine / 8-Acetonyldihydroavicine / (-)-8-Acetonyldihydroavicine
CAS RN 348098-59-9
Standard InChI InChI=1S/C23H19NO5/c1-12(25)5-18-17-9-22-21(28-11-29-22)8-16(17)14-4-3-13-6-19-20(27-10-26-19)7-15(13)23(14)24(18)2/h3-4,6-9,18H,5,10-11H2,1-2H3
Standard InChI (Main Layer) InChI=1S/C23H19NO5/c1-12(25)5-18-17-9-22-21(28-11-29-22)8-16(17)14-4-3-13-6-19-20(27-10-26-19)7-15(13)23(14)24(18)2/h3-4,6-9,18H,5,10-11H2,1-2H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 195

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN