Metabolite

KNApSAcK Entry

id C00013172
Name Acetyleumaitenol / [3R-(3alpha,4alpha,5beta,8aalpha,6alpha,9beta,9aalpha,10R*)]-4,6-bis(Acetyloxy)octahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5,10-diyl ester 3-furancarboxylic acid
CAS RN 112592-79-7
Standard InChI InChI=1S/C29H34O12/c1-15(30)37-19-7-10-27(5,34)29-22(39-24(32)17-8-11-35-13-17)20(26(3,4)41-29)21(38-16(2)31)23(28(19,29)6)40-25(33)18-9-12-36-14-18/h8-9,11-14,19-23,34H,7,10H2,1-6H3
Standard InChI (Main Layer) InChI=1S/C29H34O12/c1-15(30)37-19-7-10-27(5,34)29-22(39-24(32)17-8-11-35-13-17)20(26(3,4)41-29)21(38-16(2)31)23(28(19,29)6)40-25(33)18-9-12-36-14-18/h8-9,11-14,19-23,34H,7,10H2,1-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 173

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
Maytenus boaria 490002 Celastraceae rosids Viridiplantae