Metabolite

KNApSAcK Entry

id C00013188
Name [3R-[3alpha,5beta,5aalpha,6alpha(E),7alpha,9alpha,9aalpha]]-5,7-bis(Acetyloxy)octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-6-yl ester 3-phenyl-2-propenoic acid
CAS RN 59812-48-5
Standard InChI InChI=1S/C28H36O7/c1-17-14-22(32-18(2)29)25(34-24(31)13-12-20-10-8-7-9-11-20)27(6)23(33-19(3)30)15-21-16-28(17,27)35-26(21,4)5/h7-13,17,21-23,25H,14-16H2,1-6H3
Standard InChI (Main Layer) InChI=1S/C28H36O7/c1-17-14-22(32-18(2)29)25(34-24(31)13-12-20-10-8-7-9-11-20)27(6)23(33-19(3)30)15-21-16-28(17,27)35-26(21,4)5/h7-13,17,21-23,25H,14-16H2,1-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 3318

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 orbiculatus 85181 Celastraceae rosids Viridiplantae