Metabolite

KNApSAcK Entry

id C00047552
Name Ptilosaponoside B / (-)-Ptilosaponoside B
CAS RN 1132835-14-3
Standard InChI InChI=1S/C27H44O11S/c1-3-14-4-6-16-15-5-7-18-23(19(30)9-11-27(18,13-29)17(15)8-10-26(14,16)2)37-25-22(32)24(38-39(33,34)35)21(31)20(12-28)36-25/h3,14-25,28-32H,1,4-13H2,2H3,(H,33,34,35)/t14-,15-,16-,17-,18-,19-,20+,21+,22+,23+,24-,25-,26+,27-/m0/s1
Standard InChI (Main Layer) InChI=1S/C27H44O11S/c1-3-14-4-6-16-15-5-7-18-23(19(30)9-11-27(18,13-29)17(15)8-10-26(14,16)2)37-25-22(32)24(38-39(33,34)35)21(31)20(12-28)36-25/h3,14-25,28-32H,1,4-13H2,2H3,(H,33,34,35)

Cluster

Phytochemical cluster
KCF-S cluster No. 2187

Link

ChEMBL

By standard InChI CHEMBL1615680
By standard InChI Main Layer CHEMBL1615680

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count
Axinellidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ptilocaulis spiculifer 798311 Axinellidae Metazoa