PCIDB

KNApSAcK Metabolite C00013614

Metabolite

KNApSAcK Entry

id C00013614
Name Echitin / (-)-Echitin / Echitin(glycoside) / Apigenin 7-(2''-E-p-coumaroylglucoside / (E)-5-Hydroxy-2-(4-hydroxyphenyl)-7-[[2-O-[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one
CAS RN 177535-49-8
Standard InChI InChI=1S/C30H26O12/c31-14-24-27(37)28(38)29(42-25(36)10-3-15-1-6-17(32)7-2-15)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2/b10-3+/t24?,27-,28+,29?,30-/m1/s1
Standard InChI (Main Layer) InChI=1S/C30H26O12/c31-14-24-27(37)28(38)29(42-25(36)10-3-15-1-6-17(32)7-2-15)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 30

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
rosids 1

Family

family name count
Asteraceae 1
Salicaceae 1

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Echinops echinatus 909143 Asteraceae asterids Viridiplantae
Itoa orientalis 179731 Salicaceae rosids Viridiplantae