PCIDB

KNApSAcK Metabolite C00050057

Metabolite

KNApSAcK Entry

id C00050057
Name Delavayin C
CAS RN 186595-21-1
Standard InChI InChI=1S/C44H53N7O10/c1-25(2)38-44(61)51-20-3-5-35(51)41(58)45-24-37(55)46-32(21-26-7-13-29(52)14-8-26)39(56)47-33(22-27-9-15-30(53)16-10-27)40(57)48-34(23-28-11-17-31(54)18-12-28)43(60)50-19-4-6-36(50)42(59)49-38/h7-18,25,32-36,38,52-54H,3-6,19-24H2,1-2H3,(H,45,58)(H,46,55)(H,47,56)(H,48,57)(H,49,59)/t32-,33-,34-,35-,36-,38-/m0/s1
Standard InChI (Main Layer) InChI=1S/C44H53N7O10/c1-25(2)38-44(61)51-20-3-5-35(51)41(58)45-24-37(55)46-32(21-26-7-13-29(52)14-8-26)39(56)47-33(22-27-9-15-30(53)16-10-27)40(57)48-34(23-28-11-17-31(54)18-12-28)43(60)50-19-4-6-36(50)42(59)49-38/h7-18,25,32-36,38,52-54H,3-6,19-24H2,1-2H3,(H,45,58)(H,46,55)(H,47,56)(H,48,57)(H,49,59)

Cluster

Phytochemical cluster
KCF-S cluster No. 498

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Caryophyllaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Stellaria delavayi 13273 Caryophyllaceae eudicotyledons Viridiplantae