PCIDB

KNApSAcK Metabolite C00046965

Metabolite

KNApSAcK Entry

id C00046965
Name Watterose B / (-)-Watterose B
CAS RN 292138-63-7
Standard InChI InChI=1S/C53H62O29/c1-24(56)71-21-34-39(64)42(67)44(69)51(75-34)78-46-45(77-37(62)17-11-26-8-13-29(58)14-9-26)35(22-72-25(2)57)76-52(47(46)79-50-43(68)41(66)38(63)32(19-54)74-50)82-53(23-73-36(61)16-12-27-10-15-30(59)31(60)18-27)48(40(65)33(20-55)81-53)80-49(70)28-6-4-3-5-7-28/h3-18,32-35,38-48,50-52,54-55,58-60,63-69H,19-23H2,1-2H3/b16-12+,17-11+/t32-,33-,34-,35-,38-,39-,40-,41+,42+,43-,44-,45-,46+,47-,48+,50+,51+,52-,53+/m1/s1
Standard InChI (Main Layer) InChI=1S/C53H62O29/c1-24(56)71-21-34-39(64)42(67)44(69)51(75-34)78-46-45(77-37(62)17-11-26-8-13-29(58)14-9-26)35(22-72-25(2)57)76-52(47(46)79-50-43(68)41(66)38(63)32(19-54)74-50)82-53(23-73-36(61)16-12-27-10-15-30(59)31(60)18-27)48(40(65)33(20-55)81-53)80-49(70)28-6-4-3-5-7-28/h3-18,32-35,38-48,50-52,54-55,58-60,63-69H,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