PCIDB

KNApSAcK Metabolite C00003564

Metabolite

KNApSAcK Entry

id C00003564
Name Avenacoside A
CAS RN 24915-65-9
Standard InChI InChI=1S/C51H82O23/c1-20-31-27(73-51(20)13-12-48(3,74-51)19-65-44-38(61)36(59)33(56)28(16-52)68-44)15-26-24-7-6-22-14-23(8-10-49(22,4)25(24)9-11-50(26,31)5)67-47-43(72-46-40(63)37(60)34(57)29(17-53)69-46)41(64)42(30(18-54)70-47)71-45-39(62)35(58)32(55)21(2)66-45/h6,20-21,23-47,52-64H,7-19H2,1-5H3/t20-,21?,23-,24+,25-,26-,27-,28?,29?,30?,31-,32-,33+,34+,35-,36?,37-,38?,39?,40?,41-,42+,43?,44+,45-,46-,47+,48-,49-,50-,51-/m0/s1
Standard InChI (Main Layer) InChI=1S/C51H82O23/c1-20-31-27(73-51(20)13-12-48(3,74-51)19-65-44-38(61)36(59)33(56)28(16-52)68-44)15-26-24-7-6-22-14-23(8-10-49(22,4)25(24)9-11-50(26,31)5)67-47-43(72-46-40(63)37(60)34(57)29(17-53)69-46)41(64)42(30(18-54)70-47)71-45-39(62)35(58)32(55)21(2)66-45/h6,20-21,23-47,52-64H,7-19H2,1-5H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 21

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08887

CTD

By CAS RN

Species

Summary

Plant class

class name count
Liliopsida 1

Family

family name count
Poaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Avena sativa 4498 Poaceae Liliopsida Viridiplantae