PCIDB

KNApSAcK Metabolite C00050226

Metabolite

KNApSAcK Entry

id C00050226
Name Scupontin D / (-)-Scupontin D
CAS RN 188846-85-7
Standard InChI InChI=1S/C32H48O13/c1-16-7-25(43-20(5)34)32(15-39-26(36)8-18(3)42-27(37)9-17(2)41-19(4)33)23(12-22(35)13-31(32)14-40-31)30(16,6)24-10-21-11-28(38)45-29(21)44-24/h16-18,21-25,28-29,35,38H,7-15H2,1-6H3/t16-,17+,18+,21+,22-,23-,24+,25+,28?,29-,30+,31+,32+/m1/s1
Standard InChI (Main Layer) InChI=1S/C32H48O13/c1-16-7-25(43-20(5)34)32(15-39-26(36)8-18(3)42-27(37)9-17(2)41-19(4)33)23(12-22(35)13-31(32)14-40-31)30(16,6)24-10-21-11-28(38)45-29(21)44-24/h16-18,21-25,28-29,35,38H,7-15H2,1-6H3

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