PCIDB

KNApSAcK Metabolite C00043004

Metabolite

KNApSAcK Entry

id C00043004
Name Smilaside B / (+)-Smilaside B
CAS RN 870296-06-3
Standard InChI InChI=1S/C34H40O18/c1-17(37)48-31-30(44)28(42)24(14-35)49-33(31)52-34(16-36)32(50-27(41)11-7-19-5-9-21(39)23(13-19)46-3)29(43)25(51-34)15-47-26(40)10-6-18-4-8-20(38)22(12-18)45-2/h4-13,24-25,28-33,35-36,38-39,42-44H,14-16H2,1-3H3/b10-6+,11-7+/t24-,25-,28-,29-,30+,31-,32+,33-,34+/m1/s1
Standard InChI (Main Layer) InChI=1S/C34H40O18/c1-17(37)48-31-30(44)28(42)24(14-35)49-33(31)52-34(16-36)32(50-27(41)11-7-19-5-9-21(39)23(13-19)46-3)29(43)25(51-34)15-47-26(40)10-6-18-4-8-20(38)22(12-18)45-2/h4-13,24-25,28-33,35-36,38-39,42-44H,14-16H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 418

Link

ChEMBL

By standard InChI CHEMBL475478
By standard InChI Main Layer CHEMBL475478

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Liliopsida 1

Family

family name count
Smilacaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Smilax china 49657 Smilacaceae Liliopsida Viridiplantae