Metabolite

KNApSAcK Entry

id C00012648
Name Trichodermadiene / [4beta[2Z,4E,5(2R,3R)]]-12,13-Epoxy-trichothec-9-en-4-ol 5-(3-methyloxiranyl)-2,4-pentadienoate
CAS RN 75323-72-7
Standard InChI InChI=1S/C23H30O5/c1-14-9-10-21(3)17(11-14)27-19-12-18(22(21,4)23(19)13-25-23)28-20(24)8-6-5-7-16-15(2)26-16/h5-8,11,15-19H,9-10,12-13H2,1-4H3/t15?,16?,17?,18?,19?,21-,22?,23?/m0/s1
Standard InChI (Main Layer) InChI=1S/C23H30O5/c1-14-9-10-21(3)17(11-14)27-19-12-18(22(21,4)23(19)13-25-23)28-20(24)8-6-5-7-16-15(2)26-16/h5-8,11,15-19H,9-10,12-13H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 612

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

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
Myrothecium verrucaria 5532 Fungi