PCIDB

KNApSAcK Metabolite C00009606

Metabolite

KNApSAcK Entry

id C00009606
Name Villosol / 6a,12-Didehydrosumatrol / 6a,12a-Dehydro-alpha-toxicarol
CAS RN 60077-62-5
Standard InChI InChI=1S/C23H20O7/c1-10(2)14-6-12-16(29-14)7-13(24)21-22(25)20-11-5-17(26-3)18(27-4)8-15(11)28-9-19(20)30-23(12)21/h5,7-8,14,24H,1,6,9H2,2-4H3
Standard InChI (Main Layer) InChI=1S/C23H20O7/c1-10(2)14-6-12-16(29-14)7-13(24)21-22(25)20-11-5-17(26-3)18(27-4)8-15(11)28-9-19(20)30-23(12)21/h5,7-8,14,24H,1,6,9H2,2-4H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 236

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN C048348