PCIDB

KNApSAcK Metabolite C00049658

Metabolite

KNApSAcK Entry

id C00049658
Name Maelaxin E / (-)-Maelaxin E
CAS RN 230309-60-1
Standard InChI InChI=1S/C66H106O29/c1-11-12-13-14-38(71)89-37-23-61(4,5)21-30-29-15-16-34-63(8)19-18-36(62(6,7)33(63)17-20-64(34,9)65(29,10)22-35(70)66(30,37)26-69)90-60-54(95-57-48(81)44(77)41(74)31(24-67)87-57)50(49(82)51(92-60)55(83)84)91-59-53(46(79)42(75)32(25-68)88-59)94-58-52(45(78)40(73)28(3)86-58)93-56-47(80)43(76)39(72)27(2)85-56/h13-15,27-28,30-37,39-54,56-60,67-70,72-82H,11-12,16-26H2,1-10H3,(H,83,84)/b14-13-/t27-,28-,30-,31+,32+,33-,34+,35+,36-,37-,39-,40-,41-,42-,43+,44-,45+,46-,47+,48+,49-,50-,51-,52?,53+,54+,56-,57?,58-,59-,60+,63-,64+,65+,66-/m0/s1
Standard InChI (Main Layer) InChI=1S/C66H106O29/c1-11-12-13-14-38(71)89-37-23-61(4,5)21-30-29-15-16-34-63(8)19-18-36(62(6,7)33(63)17-20-64(34,9)65(29,10)22-35(70)66(30,37)26-69)90-60-54(95-57-48(81)44(77)41(74)31(24-67)87-57)50(49(82)51(92-60)55(83)84)91-59-53(46(79)42(75)32(25-68)88-59)94-58-52(45(78)40(73)28(3)86-58)93-56-47(80)43(76)39(72)27(2)85-56/h13-15,27-28,30-37,39-54,56-60,67-70,72-82H,11-12,16-26H2,1-10H3,(H,83,84)

Cluster

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

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL526342 CHEMBL504359

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Primulaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Maesa laxiflora 59979 Primulaceae asterids Viridiplantae