PCIDB

KNApSAcK Metabolite C00049764

Metabolite

KNApSAcK Entry

id C00049764
Name (-)-Agelastatin A
CAS RN 152406-28-5
Standard InChI InChI=1S/C12H13BrN4O3/c1-16-11(19)15-9-8-6(4-12(9,16)20)17-5(10(18)14-8)2-3-7(17)13/h2-3,6,8-9,20H,4H2,1H3,(H,14,18)(H,15,19)/t6-,8-,9+,12+/m1/s1
Standard InChI (Main Layer) InChI=1S/C12H13BrN4O3/c1-16-11(19)15-9-8-6(4-12(9,16)20)17-5(10(18)14-8)2-3-7(17)13/h2-3,6,8-9,20H,4H2,1H3,(H,14,18)(H,15,19)

Cluster

Phytochemical cluster
KCF-S cluster No. 3950

Link

ChEMBL

By standard InChI CHEMBL1096256
By standard InChI Main Layer CHEMBL1096256

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cymbastela sp.