Metabolite

KNApSAcK Entry

id C00013183
Name Celapagine / Deacetylcelapanigine / 6-(Acetyloxy)-10-(benzoyloxy)octahydro-4-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid
CAS RN 58074-71-8
Standard InChI InChI=1S/C30H35NO8/c1-17-13-14-21(36-18(2)32)29(5)25(38-27(35)20-12-9-15-31-16-20)23(33)22-24(30(17,29)39-28(22,3)4)37-26(34)19-10-7-6-8-11-19/h6-12,15-17,21-25,33H,13-14H2,1-5H3
Standard InChI (Main Layer) InChI=1S/C30H35NO8/c1-17-13-14-21(36-18(2)32)29(5)25(38-27(35)20-12-9-15-31-16-20)23(33)22-24(30(17,29)39-28(22,3)4)37-26(34)19-10-7-6-8-11-19/h6-12,15-17,21-25,33H,13-14H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 168

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Celastraceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Celastrus paniculatus 994668 Celastraceae rosids Viridiplantae