PCIDB

KNApSAcK Metabolite C00027509

Metabolite

KNApSAcK Entry

id C00027509
Name 2'-O-trans-Sinapoylalangiside
CAS RN 173180-45-5
Standard InChI InChI=1S/C36H41NO14/c1-5-19-21-13-23-20-14-24(39)25(45-2)12-18(20)8-9-37(23)34(44)22(21)16-48-35(19)51-36-33(32(43)31(42)28(15-38)49-36)50-29(40)7-6-17-10-26(46-3)30(41)27(11-17)47-4/h5-7,10-12,14,16,19,21,23,28,31-33,35-36,38-39,41-43H,1,8-9,13,15H2,2-4H3/b7-6+/t19-,21+,23-,28-,31-,32+,33-,35+,36+/m1/s1
Standard InChI (Main Layer) InChI=1S/C36H41NO14/c1-5-19-21-13-23-20-14-24(39)25(45-2)12-18(20)8-9-37(23)34(44)22(21)16-48-35(19)51-36-33(32(43)31(42)28(15-38)49-36)50-29(40)7-6-17-10-26(46-3)30(41)27(11-17)47-4/h5-7,10-12,14,16,19,21,23,28,31-33,35-36,38-39,41-43H,1,8-9,13,15H2,2-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 5314

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

Family

family name count
Cornaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Alangium lamarckii 16896 Cornaceae asterids Viridiplantae