PCIDB

KNApSAcK Metabolite C00049102

Metabolite

KNApSAcK Entry

id C00049102
Name Ajugapyrin A / (-)-Ajugapyrin A
CAS RN 202343-93-9
Standard InChI InChI=1S/C27H38O9/c1-6-13(2)22(30)36-24-27-19(33-15(4)28)9-14(3)25(5,18-10-16-7-8-31-23(16)35-18)21(27)20(29)17(34-24)11-26(27)12-32-26/h6,14,16-21,23-24,29H,7-12H2,1-5H3/b13-6+/t14-,16-,17+,18+,19+,20-,21-,23+,24-,25-,26+,27?/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H38O9/c1-6-13(2)22(30)36-24-27-19(33-15(4)28)9-14(3)25(5,18-10-16-7-8-31-23(16)35-18)21(27)20(29)17(34-24)11-26(27)12-32-26/h6,14,16-21,23-24,29H,7-12H2,1-5H3

Cluster

Phytochemical cluster No. 43
KCF-S cluster No. 172

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
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ajuga pyramidalis 38595 Lamiaceae asterids Viridiplantae