Metabolite

KNApSAcK Entry

id C00041738
Name Pentaphlorethol-B undeca acetate
CAS RN 227085-31-6
Standard InChI InChI=1S/C52H44O26/c1-23(53)64-34-12-35(65-24(2)54)14-36(13-34)75-49-41(69-28(6)58)21-40(22-42(49)70-29(7)59)76-50-47(77-51-43(71-30(8)60)15-37(66-25(3)55)16-44(51)72-31(9)61)19-39(68-27(5)57)20-48(50)78-52-45(73-32(10)62)17-38(67-26(4)56)18-46(52)74-33(11)63/h12-22H,1-11H3
Standard InChI (Main Layer) InChI=1S/C52H44O26/c1-23(53)64-34-12-35(65-24(2)54)14-36(13-34)75-49-41(69-28(6)58)21-40(22-42(49)70-29(7)59)76-50-47(77-51-43(71-30(8)60)15-37(66-25(3)55)16-44(51)72-31(9)61)19-39(68-27(5)57)20-48(50)78-52-45(73-32(10)62)17-38(67-26(4)56)18-46(52)74-33(11)63/h12-22H,1-11H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1322

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
Sargassaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cystophora retroflexa 97144 Sargassaceae Eukaryota