PCIDB

KNApSAcK Metabolite C00001667

Metabolite

KNApSAcK Entry

id C00001667
Name Spiredine
CAS RN 60062-45-5
Standard InChI InChI=1S/C22H27NO3/c1-11-9-21-10-14(24)16-20(2)4-3-5-22(16)17(21)15(25)12(11)8-13(21)18(22)23-6-7-26-19(20)23/h12-13,16-19H,1,3-10H2,2H3/t12-,13?,16-,17-,18-,19?,20-,21+,22+/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H27NO3/c1-11-9-21-10-14(24)16-20(2)4-3-5-22(16)17(21)15(25)12(11)8-13(21)18(22)23-6-7-26-19(20)23/h12-13,16-19H,1,3-10H2,2H3

Cluster

Phytochemical cluster No. 10
KCF-S cluster No. 1035

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08711

CTD

By CAS RN