PCIDB

KNApSAcK Metabolite C00005353

Metabolite

KNApSAcK Entry

id C00005353
Name Herbacetin 3-sophoroside-8-glucoside
CAS RN 77298-68-1
Standard InChI InChI=1S/C33H40O22/c34-6-13-17(40)21(44)24(47)31(49-13)53-27-12(39)5-11(38)16-20(43)29(26(52-28(16)27)9-1-3-10(37)4-2-9)54-33-30(23(46)19(42)15(8-36)51-33)55-32-25(48)22(45)18(41)14(7-35)50-32/h1-5,13-15,17-19,21-25,30-42,44-48H,6-8H2/t13?,14?,15?,17-,18-,19-,21+,22?,23?,24?,25-,30?,31+,32+,33+/m1/s1
Standard InChI (Main Layer) InChI=1S/C33H40O22/c34-6-13-17(40)21(44)24(47)31(49-13)53-27-12(39)5-11(38)16-20(43)29(26(52-28(16)27)9-1-3-10(37)4-2-9)54-33-30(23(46)19(42)15(8-36)51-33)55-32-25(48)22(45)18(41)14(7-35)50-32/h1-5,13-15,17-19,21-25,30-42,44-48H,6-8H2

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 5

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Euphyllophyta 1

Family

family name count
Equisetaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Equisetum hyemale 3262 Equisetaceae Euphyllophyta Viridiplantae