PCIDB

KNApSAcK Metabolite C00012412

Metabolite

KNApSAcK Entry

id C00012412
Name 8,9-Epoxy-8,9-secoglechomonolide / 4,7,8,11-Tetrahydro-3,6,10-trimethylfuro[2,3-b]oxacycloundecin-2(12aH)-one
CAS RN 94444-44-7
Standard InChI InChI=1S/C15H20O3/c1-10-5-4-6-11(2)9-17-15-13(8-7-10)12(3)14(16)18-15/h6-7,15H,4-5,8-9H2,1-3H3/b10-7+,11-6-
Standard InChI (Main Layer) InChI=1S/C15H20O3/c1-10-5-4-6-11(2)9-17-15-13(8-7-10)12(3)14(16)18-15/h6-7,15H,4-5,8-9H2,1-3H3

Cluster

Phytochemical cluster No. 38
KCF-S cluster No. 1710

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Apiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Smyrnium rotundifolium 489403 Apiaceae asterids Viridiplantae