PCIDB

KNApSAcK Metabolite C00050227

Metabolite

KNApSAcK Entry

id C00050227
Name Scupontin E / (-)-Scupontin E
CAS RN 188846-88-0
Standard InChI InChI=1S/C34H50O12/c1-19-12-27(45-23(5)36)34(18-41-28(37)14-21(3)44-30(39)15-22(4)43-29(38)13-20(2)35)25(8-7-10-33(34)17-42-33)32(19,6)26-16-24-9-11-40-31(24)46-26/h9,11,19-22,24-27,31,35H,7-8,10,12-18H2,1-6H3/t19-,20+,21+,22+,24-,25-,26+,27+,31+,32+,33+,34+/m1/s1
Standard InChI (Main Layer) InChI=1S/C34H50O12/c1-19-12-27(45-23(5)36)34(18-41-28(37)14-21(3)44-30(39)15-22(4)43-29(38)13-20(2)35)25(8-7-10-33(34)17-42-33)32(19,6)26-16-24-9-11-40-31(24)46-26/h9,11,19-22,24-27,31,35H,7-8,10,12-18H2,1-6H3

Cluster

Phytochemical cluster No. 43
KCF-S cluster No. 172

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
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Scutellaria pontica 4139 Lamiaceae asterids Viridiplantae