PCIDB

KNApSAcK Metabolite C00028322

Metabolite

KNApSAcK Entry

id C00028322
Name Halicylindroside B1
CAS RN 161842-90-6
Standard InChI InChI=1S/C46H90N2O10/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-29-32-39(52)45(56)48-37(42(53)38(51)31-28-25-23-20-21-24-27-30-35(2)3)34-57-46-41(47-36(4)50)44(55)43(54)40(33-49)58-46/h35,37-44,46,49,51-55H,5-34H2,1-4H3,(H,47,50)(H,48,56)
Standard InChI (Main Layer) InChI=1S/C46H90N2O10/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-29-32-39(52)45(56)48-37(42(53)38(51)31-28-25-23-20-21-24-27-30-35(2)3)34-57-46-41(47-36(4)50)44(55)43(54)40(33-49)58-46/h35,37-44,46,49,51-55H,5-34H2,1-4H3,(H,47,50)(H,48,56)

Cluster

Phytochemical cluster
KCF-S cluster No. 80

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
Halichondriidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Halichondria cylindrata 6061 Halichondriidae Metazoa