Metabolite

KNApSAcK Entry

id C00010565
Name [1S-(1alpha,4aalpha,7aalpha)]-7-[(acetyloxy)methyl]-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
CAS RN 62218-50-2
Standard InChI InChI=1S/C19H26O11/c1-8(21)27-6-9-3-4-10-11(17(25)26-2)7-28-18(13(9)10)30-19-16(24)15(23)14(22)12(5-20)29-19/h3,7,10,12-16,18-20,22-24H,4-6H2,1-2H3/t10?,12?,13?,14-,15+,16?,18?,19+/m1/s1
Standard InChI (Main Layer) InChI=1S/C19H26O11/c1-8(21)27-6-9-3-4-10-11(17(25)26-2)7-28-18(13(9)10)30-19-16(24)15(23)14(22)12(5-20)29-19/h3,7,10,12-16,18-20,22-24H,4-6H2,1-2H3

Cluster

Phytochemical cluster No. 36
KCF-S cluster No. 100

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1078435

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Gardenia jasminoides 114476 Rubiaceae asterids Viridiplantae