PCIDB

KNApSAcK Metabolite C00027342

Metabolite

KNApSAcK Entry

id C00027342
Name Demethylisoalangiside
CAS RN 169531-70-8
Standard InChI InChI=1S/C24H29NO10/c1-2-11-13-6-15-12-7-17(28)16(27)5-10(12)3-4-25(15)22(32)14(13)9-33-23(11)35-24-21(31)20(30)19(29)18(8-26)34-24/h2,5,7,9,11,13,15,18-21,23-24,26-31H,1,3-4,6,8H2/t11-,13+,15+,18-,19-,20+,21-,23+,24?/m1/s1
Standard InChI (Main Layer) InChI=1S/C24H29NO10/c1-2-11-13-6-15-12-7-17(28)16(27)5-10(12)3-4-25(15)22(32)14(13)9-33-23(11)35-24-21(31)20(30)19(29)18(8-26)34-24/h2,5,7,9,11,13,15,18-21,23-24,26-31H,1,3-4,6,8H2

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 577

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C11814

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cephaelis acuminata 77880 Rubiaceae asterids Viridiplantae