PCIDB

KNApSAcK Metabolite C00016233

Metabolite

KNApSAcK Entry

id C00016233
Name A 108836
CAS RN 178560-44-6
Standard InChI InChI=1S/C31H50O6S/c1-18(2)19(3)10-11-20(4)22-13-14-23-21-12-15-26-29(5,6)28(37-38(33,34)35)25(32)17-30(26,7)24(21)16-27(36-9)31(22,23)8/h12,16,18,20,22-23,25-28,32H,3,10-11,13-15,17H2,1-2,4-9H3,(H,33,34,35)/t20-,22-,23+,25-,26+,27+,28+,30-,31-/m1/s1
Standard InChI (Main Layer) InChI=1S/C31H50O6S/c1-18(2)19(3)10-11-20(4)22-13-14-23-21-12-15-26-29(5,6)28(37-38(33,34)35)25(32)17-30(26,7)24(21)16-27(36-9)31(22,23)8/h12,16,18,20,22-23,25-28,32H,3,10-11,13-15,17H2,1-2,4-9H3,(H,33,34,35)

Cluster

Phytochemical cluster
KCF-S cluster No. 3717

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
Nectriaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Fusarium compactum 867872 Nectriaceae Fungi