PCIDB

KNApSAcK Metabolite C00018129

Metabolite

KNApSAcK Entry

id C00018129
Name Papulacandin C
CAS RN 61036-48-4
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+/t28?,31?,33?,35?,36?,40-,41-,42?,43?,44?,45?,46-,47?/m0/s1
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

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