PCIDB

KNApSAcK Metabolite C00050116

Metabolite

KNApSAcK Entry

id C00050116
Name Halishigamide A
CAS RN 185847-11-4
Standard InChI InChI=1S/C44H63N5O12/c1-26-12-9-10-14-40-46-33(23-58-40)43-48-34(24-60-43)44-47-32(22-59-44)42(57-8)29(4)36(53)19-30(45)18-31(51)20-41(54)61-39(26)21-38(56-7)27(2)15-16-35(52)28(3)37(55-6)13-11-17-49(5)25-50/h10-11,14,17,22-31,37-39,42,51H,9,12-13,15-16,18-21,45H2,1-8H3/b14-10-,17-11+/t26-,27+,28+,29+,30+,31+,37-,38+,39+,42+/m1/s1
Standard InChI (Main Layer) InChI=1S/C44H63N5O12/c1-26-12-9-10-14-40-46-33(23-58-40)43-48-34(24-60-43)44-47-32(22-59-44)42(57-8)29(4)36(53)19-30(45)18-31(51)20-41(54)61-39(26)21-38(56-7)27(2)15-16-35(52)28(3)37(55-6)13-11-17-49(5)25-50/h10-11,14,17,22-31,37-39,42,51H,9,12-13,15-16,18-21,45H2,1-8H3

Cluster

Phytochemical cluster
KCF-S cluster No. 474

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL453976

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 sp. 6061 Halichondriidae Metazoa