PCIDB

KNApSAcK Metabolite C00024354

Metabolite

KNApSAcK Entry

id C00024354
Name Yemenine A / 3-Acetylhamayne / 3-O-Acetylhamayne / Hamayne 3-acetate / O-Demethylcrinamine 3-acetate
CAS RN 93376-07-9
Standard InChI InChI=1S/C18H19NO5/c1-10(20)24-12-2-3-18-13-6-15-14(22-9-23-15)4-11(13)7-19(8-17(18)21)16(18)5-12/h2-4,6,12,16-17,21H,5,7-9H2,1H3/t12-,16+,17?,18+/m1/s1
Standard InChI (Main Layer) InChI=1S/C18H19NO5/c1-10(20)24-12-2-3-18-13-6-15-14(22-9-23-15)4-11(13)7-19(8-17(18)21)16(18)5-12/h2-4,6,12,16-17,21H,5,7-9H2,1H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 103

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL469438

KEGG

By LinkDB C12165

CTD

By CAS RN