PCIDB

KNApSAcK Metabolite C00031587

Metabolite

KNApSAcK Entry

id C00031587
Name Ajugamarin C1
CAS RN 121449-64-7
Standard InChI InChI=1S/C24H34O9/c1-13-7-19(33-15(3)26)24(12-31-14(2)25)21(17(27)5-6-23(24)11-32-23)22(13,4)9-18(28)16-8-20(29)30-10-16/h8,13,17-19,21,27-28H,5-7,9-12H2,1-4H3/t13-,17-,18+,19+,21-,22+,23+,24-/m1/s1
Standard InChI (Main Layer) InChI=1S/C24H34O9/c1-13-7-19(33-15(3)26)24(12-31-14(2)25)21(17(27)5-6-23(24)11-32-23)22(13,4)9-18(28)16-8-20(29)30-10-16/h8,13,17-19,21,27-28H,5-7,9-12H2,1-4H3

Cluster

Phytochemical cluster No. 43
KCF-S cluster No. 1360

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 taiwanensis 946572 Lamiaceae asterids Viridiplantae