PCIDB

KNApSAcK Metabolite C00046971

Metabolite

KNApSAcK Entry

id C00046971
Name Watterose H / (-)-Watterose H
CAS RN 292135-86-5
Standard InChI InChI=1S/C51H60O27/c1-24(54)67-21-32-36(59)39(62)41(64)49(71-32)74-43-42(73-34(57)18-15-26-13-16-29(56)17-14-26)33(22-68-25(2)55)72-50(44(43)75-48-40(63)38(61)35(58)30(19-52)70-48)78-51(23-69-46(65)27-9-5-3-6-10-27)45(37(60)31(20-53)77-51)76-47(66)28-11-7-4-8-12-28/h3-18,30-33,35-45,48-50,52-53,56,58-64H,19-23H2,1-2H3/b18-15+/t30-,31-,32-,33-,35-,36-,37-,38+,39+,40-,41-,42-,43+,44-,45+,48+,49+,50-,51+/m1/s1
Standard InChI (Main Layer) InChI=1S/C51H60O27/c1-24(54)67-21-32-36(59)39(62)41(64)49(71-32)74-43-42(73-34(57)18-15-26-13-16-29(56)17-14-26)33(22-68-25(2)55)72-50(44(43)75-48-40(63)38(61)35(58)30(19-52)70-48)78-51(23-69-46(65)27-9-5-3-6-10-27)45(37(60)31(20-53)77-51)76-47(66)28-11-7-4-8-12-28/h3-18,30-33,35-45,48-50,52-53,56,58-64H,19-23H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 181

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
Polygalaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Polygala wattersii 4275 Polygalaceae rosids Viridiplantae