PCIDB

KNApSAcK Metabolite C00034007

Metabolite

KNApSAcK Entry

id C00034007
Name Kunzeaphlogin C / (-)-Kunzeaphlogin C
CAS RN 1109229-47-1
Standard InChI InChI=1S/C44H46O26/c1-3-13(2)29(52)28-24(68-44-38(61)35(58)33(56)25(69-44)11-65-41(62)14-4-18(46)30(53)19(47)5-14)10-17(45)27(34(28)57)40-37(60)36(59)39(70-43(64)16-8-22(50)32(55)23(51)9-16)26(67-40)12-66-42(63)15-6-20(48)31(54)21(49)7-15/h4-10,13,25-26,33,35-40,44-51,53-61H,3,11-12H2,1-2H3/t13?,25-,26-,33-,35+,36-,37-,38-,39-,40+,44-/m1/s1
Standard InChI (Main Layer) InChI=1S/C44H46O26/c1-3-13(2)29(52)28-24(68-44-38(61)35(58)33(56)25(69-44)11-65-41(62)14-4-18(46)30(53)19(47)5-14)10-17(45)27(34(28)57)40-37(60)36(59)39(70-43(64)16-8-22(50)32(55)23(51)9-16)26(67-40)12-66-42(63)15-6-20(48)31(54)21(49)7-15/h4-10,13,25-26,33,35-40,44-51,53-61H,3,11-12H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2601

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
Kunzea ambigua 106041 Myrtaceae rosids Viridiplantae