PCIDB

KNApSAcK Metabolite C00016806

Metabolite

KNApSAcK Entry

id C00016806
Name Gambieric acid A
CAS RN 138434-64-7
Standard InChI InChI=1S/C59H92O16/c1-30(18-31(2)28-60)19-42-33(4)21-48-56(7,74-42)27-46-54(71-48)55(65)59(10)50(69-46)26-45-53(75-59)32(3)12-11-13-40-39(67-45)16-17-47-57(8,72-40)29-58(9)49(70-47)25-44-41(73-58)15-14-38(62)43(68-44)24-36(61)23-37-20-34(5)52(66-37)35(6)22-51(63)64/h11-12,18,31-32,34-50,52-55,60-62,65H,4,13-17,19-29H2,1-3,5-10H3,(H,63,64)/b12-11-,30-18+/t31-,32+,34-,35+,36-,37+,38-,39+,40-,41+,42-,43+,44-,45-,46-,47-,48-,49+,50+,52+,53+,54-,55+,56+,57+,58-,59+/m1/s1
Standard InChI (Main Layer) InChI=1S/C59H92O16/c1-30(18-31(2)28-60)19-42-33(4)21-48-56(7,74-42)27-46-54(71-48)55(65)59(10)50(69-46)26-45-53(75-59)32(3)12-11-13-40-39(67-45)16-17-47-57(8,72-40)29-58(9)49(70-47)25-44-41(73-58)15-14-38(62)43(68-44)24-36(61)23-37-20-34(5)52(66-37)35(6)22-51(63)64/h11-12,18,31-32,34-50,52-55,60-62,65H,4,13-17,19-29H2,1-3,5-10H3,(H,63,64)

Cluster

Phytochemical cluster
KCF-S cluster No. 2725

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C16885

CTD

By CAS RN C080898

Species

Summary

Plant class

class name count

Family

family name count
Goniodomataceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Gambierdiscus toxicus 373098 Goniodomataceae Eukaryota