PCIDB

KNApSAcK Metabolite C00019727

Metabolite

KNApSAcK Entry

id C00019727
Name (3R)-7,2',5'-Trihydroxy-3',4'-dimethoxyisoflavan 2',5'-O-diglucoside
CAS RN 137217-85-7
Standard InChI InChI=1S/C29H38O16/c1-39-26-16(42-28-23(37)21(35)19(33)17(8-30)43-28)7-14(12-5-11-3-4-13(32)6-15(11)41-10-12)25(27(26)40-2)45-29-24(38)22(36)20(34)18(9-31)44-29/h3-4,6-7,12,17-24,28-38H,5,8-10H2,1-2H3/t12-,17?,18?,19+,20+,21-,22-,23?,24?,28+,29-/m0/s1
Standard InChI (Main Layer) InChI=1S/C29H38O16/c1-39-26-16(42-28-23(37)21(35)19(33)17(8-30)43-28)7-14(12-5-11-3-4-13(32)6-15(11)41-10-12)25(27(26)40-2)45-29-24(38)22(36)20(34)18(9-31)44-29/h3-4,6-7,12,17-24,28-38H,5,8-10H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 152

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Fabaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Astragalus mongholicus 119829 Fabaceae rosids Viridiplantae