Metabolite

KNApSAcK Entry

id C00045173
Name 2-Deoxy-20-hydroxyecdysone
CAS RN 17942-08-4
Standard InChI InChI=1S/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3/t16-,17-,19-,21-,22+,24+,25+,26+,27+/m0/s1
Standard InChI (Main Layer) InChI=1S/C27H44O6/c1-23(2,31)10-9-22(30)26(5,32)21-8-13-27(33)18-15-20(29)19-14-16(28)6-11-24(19,3)17(18)7-12-25(21,27)4/h15-17,19,21-22,28,30-33H,6-14H2,1-5H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 58

Link

ChEMBL

By standard InChI CHEMBL2087143
By standard InChI Main Layer CHEMBL2087143

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count
Zoanthidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Zoanthus sp. 105402 Zoanthidae Metazoa

Human Protein / Gene in interaction

1 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P08183 Multidrug resistance protein 1 drug CHEMBL2087143 CHEMBL2091088 (1) CHEMBL2091094 (1)
CHEMBL2091097 (1) CHEMBL2091100 (1)
1 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (1)

OMIM preferred title UniProt
#612244 Inflammatory bowel disease 13; ibd13 P08183