PCIDB

KNApSAcK Metabolite C00034281

Metabolite

KNApSAcK Entry

id C00034281
Name Squarrosanin B
CAS RN 1110784-04-7
Standard InChI InChI=1S/C41H28O26/c42-10-1-7(2-11(43)24(10)47)37(58)65-16-6-63-38(59)8-3-12(44)26(49)28(51)17(8)18-9(4-13(45)27(50)29(18)52)39(60)66-35(16)34(57)32(55)30(53)22-21-20-19-15(64-40(21)61)5-14(46)25(48)23(19)41(62)67-36(20)33(56)31(22)54/h1-5,16,30,32,34-35,42-57H,6H2
Standard InChI (Main Layer) InChI=1S/C41H28O26/c42-10-1-7(2-11(43)24(10)47)37(58)65-16-6-63-38(59)8-3-12(44)26(49)28(51)17(8)18-9(4-13(45)27(50)29(18)52)39(60)66-35(16)34(57)32(55)30(53)22-21-20-19-15(64-40(21)61)5-14(46)25(48)23(19)41(62)67-36(20)33(56)31(22)54/h1-5,16,30,32,34-35,42-57H,6H2

Cluster

Phytochemical cluster
KCF-S cluster No. 3879

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
Myrtaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Melaleuca squarrosa 164925 Myrtaceae rosids Viridiplantae