PCIDB

KNApSAcK Metabolite C00038831

Metabolite

KNApSAcK Entry

id C00038831
Name Copteroside E
CAS RN 86438-29-1
Standard InChI InChI=1S/C52H82O22/c1-48(2)16-22-21(23(17-48)43(66)74-46-37(62)34(59)33(58)27(18-53)69-46)10-14-51(6)24(22)8-9-29-50(5)13-12-30(49(3,4)28(50)11-15-52(29,51)7)70-47-40(72-45-36(61)32(57)26(55)20-68-45)38(63)39(41(73-47)42(64)65)71-44-35(60)31(56)25(54)19-67-44/h8,21-23,25-41,44-47,53-63H,9-20H2,1-7H3,(H,64,65)/t21?,22-,23-,25-,26-,27-,28+,29-,30+,31+,32+,33-,34+,35-,36-,37-,38+,39+,40-,41+,44+,45+,46+,47-,50+,51-,52-/m1/s1
Standard InChI (Main Layer) InChI=1S/C52H82O22/c1-48(2)16-22-21(23(17-48)43(66)74-46-37(62)34(59)33(58)27(18-53)69-46)10-14-51(6)24(22)8-9-29-50(5)13-12-30(49(3,4)28(50)11-15-52(29,51)7)70-47-40(72-45-36(61)32(57)26(55)20-68-45)38(63)39(41(73-47)42(64)65)71-44-35(60)31(56)25(54)19-67-44/h8,21-23,25-41,44-47,53-63H,9-20H2,1-7H3,(H,64,65)

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 4

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Amaranthaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Climacoptera transoxana 3563 Amaranthaceae eudicotyledons Viridiplantae