PCIDB

KNApSAcK Metabolite C00003316

Metabolite

KNApSAcK Entry

id C00003316
Name Ligulatin B
CAS RN 31299-06-6
Standard InChI InChI=1S/C17H22O5/c1-9-4-5-12-10(2)16(20)22-15(12)17(8-21-11(3)18)13(9)6-7-14(17)19/h9,12-13,15H,2,4-8H2,1,3H3/t9-,12-,13-,15+,17-/m0/s1
Standard InChI (Main Layer) InChI=1S/C17H22O5/c1-9-4-5-12-10(2)16(20)22-15(12)17(8-21-11(3)18)13(9)6-7-14(17)19/h9,12-13,15H,2,4-8H2,1,3H3

Cluster

Phytochemical cluster No. 38
KCF-S cluster No. 2862

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C09494

CTD

By CAS RN