PCIDB

KNApSAcK Metabolite C00037965

Metabolite

KNApSAcK Entry

id C00037965
Name Tubacetine
CAS RN 144442-82-0
Standard InChI InChI=1S/C29H37NO7/c1-20(31)35-25(28(3,4)36-21(2)32)15-17-29(5)26(37-29)19-34-24-13-11-22(12-14-24)16-18-30-27(33)23-9-7-6-8-10-23/h6-14,25-26H,15-19H2,1-5H3,(H,30,33)
Standard InChI (Main Layer) InChI=1S/C29H37NO7/c1-20(31)35-25(28(3,4)36-21(2)32)15-17-29(5)26(37-29)19-34-24-13-11-22(12-14-24)16-18-30-27(33)23-9-7-6-8-10-23/h6-14,25-26H,15-19H2,1-5H3,(H,30,33)

Cluster

Phytochemical cluster
KCF-S cluster No. 5525

Link

ChEMBL

By standard InChI CHEMBL1991947
By standard InChI Main Layer CHEMBL477734 CHEMBL1991947

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
Haplophyllum tuberculatum (Forssk.) Al Juss. 266078 Rutaceae rosids Viridiplantae