PCIDB

KNApSAcK Metabolite C00039960

Metabolite

KNApSAcK Entry

id C00039960
Name Pescaprein III / (-)-Pescaprein III
CAS RN 849042-49-5
Standard InChI InChI=1S/C63H110O24/c1-10-13-15-16-17-18-21-24-29-33-42(65)82-57-56(87-59-48(71)45(68)43(66)35(5)75-59)53(84-60-49(72)47(70)51(37(7)77-60)83-58(74)34(4)12-3)39(9)79-63(57)85-52-38(8)78-61-50(73)54(52)81-41(64)32-28-25-22-19-20-23-27-31-40(30-26-14-11-2)80-62-55(86-61)46(69)44(67)36(6)76-62/h34-40,43-57,59-63,66-73H,10-33H2,1-9H3/t34-,35-,36+,37-,38-,39-,40-,43-,44-,45+,46-,47-,48+,49+,50?,51-,52-,53-,54-,55+,56+,57+,59?,60-,61-,62-,63-/m0/s1
Standard InChI (Main Layer) InChI=1S/C63H110O24/c1-10-13-15-16-17-18-21-24-29-33-42(65)82-57-56(87-59-48(71)45(68)43(66)35(5)75-59)53(84-60-49(72)47(70)51(37(7)77-60)83-58(74)34(4)12-3)39(9)79-63(57)85-52-38(8)78-61-50(73)54(52)81-41(64)32-28-25-22-19-20-23-27-31-40(30-26-14-11-2)80-62-55(86-61)46(69)44(67)36(6)76-62/h34-40,43-57,59-63,66-73H,10-33H2,1-9H3

Cluster

Phytochemical cluster
KCF-S cluster No. 87

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL504178

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Convolvulaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ipomoea murucoides 1393930 Convolvulaceae asterids Viridiplantae
Ipomoea pes-caprae 89656 Convolvulaceae asterids Viridiplantae