PCIDB

KNApSAcK Metabolite C00013965

Metabolite

KNApSAcK Entry

id C00013965
Name Myricetin 3-neohesperidoside / 3-[[2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one
CAS RN 431887-48-8
Standard InChI InChI=1S/C27H30O17/c1-7-16(33)20(37)22(39)26(40-7)44-25-21(38)18(35)14(6-28)42-27(25)43-24-19(36)15-10(30)4-9(29)5-13(15)41-23(24)8-2-11(31)17(34)12(32)3-8/h2-5,7,14,16,18,20-22,25-35,37-39H,6H2,1H3/t7?,14?,16-,18+,20?,21-,22-,25?,26-,27-/m0/s1
Standard InChI (Main Layer) InChI=1S/C27H30O17/c1-7-16(33)20(37)22(39)26(40-7)44-25-21(38)18(35)14(6-28)42-27(25)43-24-19(36)15-10(30)4-9(29)5-13(15)41-23(24)8-2-11(31)17(34)12(32)3-8/h2-5,7,14,16,18,20-22,25-35,37-39H,6H2,1H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 1

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1
rosids 1

Family

family name count
Solanaceae 1
Fabaceae 1

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Clitoria ternatea 43366 Fabaceae rosids Viridiplantae
Physalis angulata 113208 Solanaceae asterids Viridiplantae