PCIDB

KNApSAcK Metabolite C00029387

Metabolite

KNApSAcK Entry

id C00029387
Name 12-O-methylcarnosic acid / 12-O-Methyl carnosic acid / (+)-12-O-Methyl carnosic acid / Carnosic acid 12-methyl ether
CAS RN 62201-71-2
Standard InChI InChI=1S/C21H30O4/c1-12(2)14-11-13-7-8-15-20(3,4)9-6-10-21(15,19(23)24)16(13)17(22)18(14)25-5/h11-12,15,22H,6-10H2,1-5H3,(H,23,24)/t15-,21+/m0/s1
Standard InChI (Main Layer) InChI=1S/C21H30O4/c1-12(2)14-11-13-7-8-15-20(3,4)9-6-10-21(15,19(23)24)16(13)17(22)18(14)25-5/h11-12,15,22H,6-10H2,1-5H3,(H,23,24)

Cluster

Phytochemical cluster No. 41
KCF-S cluster No. 323

Link

ChEMBL

By standard InChI CHEMBL1096627
By standard InChI Main Layer CHEMBL1096627

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Lamiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Perovskia scrophularifolia 39175 Lamiaceae asterids Viridiplantae
Salvia officinalis 38868 Lamiaceae asterids Viridiplantae