PCIDB

KNApSAcK Metabolite C00019897

Metabolite

KNApSAcK Entry

id C00019897
Name (E,E)-8-(7-Hydroxy-3,7-dimethylocta-2,5-dienyloxy) psoralen
CAS RN 144398-34-5
Standard InChI InChI=1S/C21H22O5/c1-14(5-4-10-21(2,3)23)8-11-25-20-18-16(9-12-24-18)13-15-6-7-17(22)26-19(15)20/h4,6-10,12-13,23H,5,11H2,1-3H3/b10-4+,14-8+
Standard InChI (Main Layer) InChI=1S/C21H22O5/c1-14(5-4-10-21(2,3)23)8-11-25-20-18-16(9-12-24-18)13-15-6-7-17(22)26-19(15)20/h4,6-10,12-13,23H,5,11H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1664

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Rutaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Phebalium tuberculosum ssp. megaphyllum 77003 Rutaceae rosids Viridiplantae