PCIDB

KNApSAcK Metabolite C00027236

Metabolite

KNApSAcK Entry

id C00027236
Name Scutianine C
CAS RN 53766-26-0
Standard InChI InChI=1S/C31H42N4O4/c1-7-21(4)27(35(5)6)31(38)34-26-28(20(2)3)39-24-15-13-22(14-16-24)17-18-32-29(36)25(33-30(26)37)19-23-11-9-8-10-12-23/h8-18,20-21,25-28H,7,19H2,1-6H3,(H,32,36)(H,33,37)(H,34,38)/b18-17+/t21-,25+,26+,27+,28+/m1/s1
Standard InChI (Main Layer) InChI=1S/C31H42N4O4/c1-7-21(4)27(35(5)6)31(38)34-26-28(20(2)3)39-24-15-13-22(14-16-24)17-18-32-29(36)25(33-30(26)37)19-23-11-9-8-10-12-23/h8-18,20-21,25-28H,7,19H2,1-6H3,(H,32,36)(H,33,37)(H,34,38)

Cluster

Phytochemical cluster
KCF-S cluster No. 134

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL560565

KEGG

By LinkDB

CTD

By CAS RN