PCIDB

KNApSAcK Metabolite C00024912

Metabolite

KNApSAcK Entry

id C00024912
Name Ignavine
CAS RN 1357-76-2
Standard InChI InChI=1S/C27H31NO5/c1-13-15-8-16-20-26-11-18(33-23(31)14-6-4-3-5-7-14)22(30)24(2)12-28(20)17(19(24)26)10-25(16,21(13)29)27(26,32)9-15/h3-7,15-22,29-30,32H,1,8-12H2,2H3/t15-,16+,17-,18+,19?,20?,21+,22-,24+,25?,26+,27-/m0/s1
Standard InChI (Main Layer) InChI=1S/C27H31NO5/c1-13-15-8-16-20-26-11-18(33-23(31)14-6-4-3-5-7-14)22(30)24(2)12-28(20)17(19(24)26)10-25(16,21(13)29)27(26,32)9-15/h3-7,15-22,29-30,32H,1,8-12H2,2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 317

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C17485

CTD

By CAS RN C035745