PCIDB

KNApSAcK Metabolite C00035899

Metabolite

KNApSAcK Entry

id C00035899
Name Yadanzioside C
CAS RN 95258-16-5
Standard InChI InChI=1S/C34H46O17/c1-12(31(3,4)45)7-18(36)51-24-26-33-11-47-34(26,30(44)46-6)27(42)23(41)25(33)32(5)9-15(19(37)13(2)14(32)8-17(33)50-28(24)43)48-29-22(40)21(39)20(38)16(10-35)49-29/h7,9,13-14,16-17,20-27,29,35,38-42,45H,8,10-11H2,1-6H3/b12-7+/t13-,14-,16+,17+,20+,21-,22+,23+,24+,25+,26+,27-,29+,32-,33+,34-/m0/s1
Standard InChI (Main Layer) InChI=1S/C34H46O17/c1-12(31(3,4)45)7-18(36)51-24-26-33-11-47-34(26,30(44)46-6)27(42)23(41)25(33)32(5)9-15(19(37)13(2)14(32)8-17(33)50-28(24)43)48-29-22(40)21(39)20(38)16(10-35)49-29/h7,9,13-14,16-17,20-27,29,35,38-42,45H,8,10-11H2,1-6H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 875

Link

ChEMBL

By standard InChI CHEMBL2029085
By standard InChI Main Layer CHEMBL499465 CHEMBL2029085

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Simaroubaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Brucea amarissima (Lour.) Desv.ex B.A.Gomes 43722 Simaroubaceae rosids Viridiplantae