PCIDB

KNApSAcK Metabolite C00034434

Metabolite

KNApSAcK Entry

id C00034434
Name Asparagamine A / Didehydrostemofoline
CAS RN 156798-15-1
Standard InChI InChI=1S/C22H27NO5/c1-5-6-7-21-13-9-23-20(21)22-15(12(13)8-14(21)27-22)10(2)17(28-22)18-16(25-4)11(3)19(24)26-18/h6-7,10,12-15,20,23H,5,8-9H2,1-4H3/b7-6+,18-17-/t10-,12+,13?,14-,15+,20+,21?,22?/m0/s1
Standard InChI (Main Layer) InChI=1S/C22H27NO5/c1-5-6-7-21-13-9-23-20(21)22-15(12(13)8-14(21)27-22)10(2)17(28-22)18-16(25-4)11(3)19(24)26-18/h6-7,10,12-15,20,23H,5,8-9H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 372

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN