PCIDB

KNApSAcK Metabolite C00040925

Metabolite

KNApSAcK Entry

id C00040925
Name Clerodendrin H
CAS RN 220858-39-9
Standard InChI InChI=1S/C33H46O14/c1-16-11-26(44-20(5)36)32(14-41-18(3)34)24(30(16,7)25-12-22-9-10-40-28(22)45-25)13-23(38)27(33(32)15-42-33)46-29(39)31(8,47-21(6)37)17(2)43-19(4)35/h9-10,16-17,22-28,38H,11-15H2,1-8H3/t16-,17?,22-,23-,24-,25+,26+,27+,28+,30+,31?,32+,33-/m1/s1
Standard InChI (Main Layer) InChI=1S/C33H46O14/c1-16-11-26(44-20(5)36)32(14-41-18(3)34)24(30(16,7)25-12-22-9-10-40-28(22)45-25)13-23(38)27(33(32)15-42-33)46-29(39)31(8,47-21(6)37)17(2)43-19(4)35/h9-10,16-17,22-28,38H,11-15H2,1-8H3

Cluster

Phytochemical cluster No. 43
KCF-S cluster No. 172

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
Tenthredinidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Athalia rosae ruficornis 1170497 Tenthredinidae Metazoa