PCIDB

KNApSAcK Metabolite C00016076

Metabolite

KNApSAcK Entry

id C00016076
Name Papulacandin B
CAS RN 61032-80-2
Standard InChI InChI=1S/C47H64O17/c1-5-28(3)17-11-9-12-18-29(4)33(51)20-14-10-16-22-38(54)62-44-43(35(25-48)64-47(45(44)58)39-30(26-60-47)23-32(50)24-34(39)52)63-46-42(57)41(56)40(55)36(61-46)27-59-37(53)21-15-8-7-13-19-31(49)6-2/h7-10,12-16,18-19,21-24,28,31,33,35-36,40-46,48-52,55-58H,5-6,11,17,20,25-27H2,1-4H3/b8-7+,12-9+,14-10+,19-13+,21-15+,22-16+,29-18+
Standard InChI (Main Layer) InChI=1S/C47H64O17/c1-5-28(3)17-11-9-12-18-29(4)33(51)20-14-10-16-22-38(54)62-44-43(35(25-48)64-47(45(44)58)39-30(26-60-47)23-32(50)24-34(39)52)63-46-42(57)41(56)40(55)36(61-46)27-59-37(53)21-15-8-7-13-19-31(49)6-2/h7-10,12-16,18-19,21-24,28,31,33,35-36,40-46,48-52,55-58H,5-6,11,17,20,25-27H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 789

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL355763 CHEMBL448981

KEGG

By LinkDB

CTD

By CAS RN C020789

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Aizoaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Papularia sphaerosperma 3542 Aizoaceae eudicotyledons Viridiplantae