PCIDB

KNApSAcK Metabolite C00040591

Metabolite

KNApSAcK Entry

id C00040591
Name Tyrianthin 3 / (-)-Tyrianthin 3
CAS RN 930106-38-0
Standard InChI InChI=1S/C55H92O24/c1-11-13-19-22-34-23-20-17-15-14-16-18-21-24-36(58)74-47-44(77-52-42(64)41(63)43(32(9)70-52)75-49(65)26(3)12-2)33(10)71-55(48(47)76-51(67)28(5)30(7)57)79-46-40(62)38(60)35(25-68-50(66)27(4)29(6)56)73-54(46)78-45-39(61)37(59)31(8)69-53(45)72-34/h12,27-35,37-48,52-57,59-64H,11,13-25H2,1-10H3/b26-12+/t27?,28?,29?,30?,31-,32-,33+,34?,35-,37-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47-,48?,52+,53+,54+,55+/m1/s1
Standard InChI (Main Layer) InChI=1S/C55H92O24/c1-11-13-19-22-34-23-20-17-15-14-16-18-21-24-36(58)74-47-44(77-52-42(64)41(63)43(32(9)70-52)75-49(65)26(3)12-2)33(10)71-55(48(47)76-51(67)28(5)30(7)57)79-46-40(62)38(60)35(25-68-50(66)27(4)29(6)56)73-54(46)78-45-39(61)37(59)31(8)69-53(45)72-34/h12,27-35,37-48,52-57,59-64H,11,13-25H2,1-10H3

Cluster

Phytochemical cluster
KCF-S cluster No. 87

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Convolvulaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ipomoea tyrianthina 4119 Convolvulaceae asterids Viridiplantae