PCIDB

KNApSAcK Metabolite C00003746

Metabolite

KNApSAcK Entry

id C00003746
Name Fernen / Fernene / Fern-9-ene / Fern 9(11)-ene
CAS RN 1615-99-2
Standard InChI InChI=1S/C30H50/c1-20(2)21-10-13-25-28(21,6)18-19-29(7)23-11-12-24-26(3,4)15-9-16-27(24,5)22(23)14-17-30(25,29)8/h14,20-21,23-25H,9-13,15-19H2,1-8H3/t21-,23+,24+,25-,27-,28-,29-,30+/m1/s1
Standard InChI (Main Layer) InChI=1S/C30H50/c1-20(2)21-10-13-25-28(21,6)18-19-29(7)23-11-12-24-26(3,4)15-9-16-27(24,5)22(23)14-17-30(25,29)8/h14,20-21,23-25H,9-13,15-19H2,1-8H3

Cluster

Phytochemical cluster No. 52
KCF-S cluster No. 198

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08625

CTD

By CAS RN