PCIDB

KNApSAcK Metabolite C00028859

Metabolite

KNApSAcK Entry

id C00028859
Name Prenylagaramide B
CAS RN 226894-88-8
Standard InChI InChI=1S/C49H68N8O10/c1-7-29(5)41-46(63)52-36(26-31-13-17-33(58)18-14-31)48(65)57-23-10-12-39(57)45(62)55-42(30(6)8-2)47(64)53-37(27-40(50)59)49(66)56-22-9-11-38(56)44(61)51-35(43(60)54-41)25-32-15-19-34(20-16-32)67-24-21-28(3)4/h13-21,29-30,35-39,41-42,58H,7-12,22-27H2,1-6H3,(H2,50,59)(H,51,61)(H,52,63)(H,53,64)(H,54,60)(H,55,62)/t29?,30-,35-,36-,37-,38-,39-,41-,42?/m0/s1
Standard InChI (Main Layer) InChI=1S/C49H68N8O10/c1-7-29(5)41-46(63)52-36(26-31-13-17-33(58)18-14-31)48(65)57-23-10-12-39(57)45(62)55-42(30(6)8-2)47(64)53-37(27-40(50)59)49(66)56-22-9-11-38(56)44(61)51-35(43(60)54-41)25-32-15-19-34(20-16-32)67-24-21-28(3)4/h13-21,29-30,35-39,41-42,58H,7-12,22-27H2,1-6H3,(H2,50,59)(H,51,61)(H,52,63)(H,53,64)(H,54,60)(H,55,62)

Cluster

Phytochemical cluster
KCF-S cluster No. 498

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Oscillatoria agardhii 1160 Bacteria