PCIDB

KNApSAcK Metabolite C00046559

Metabolite

KNApSAcK Entry

id C00046559
Name 14-Acetylbearline
CAS RN 253328-43-7
Standard InChI InChI=1S/C39H50N2O12/c1-7-40-17-36(18-51-34(46)22-10-8-9-11-25(22)41-28(44)14-19(2)33(41)45)13-12-27(49-5)38-24-15-23-26(52-20(3)42)16-37(47,29(24)30(23)53-21(4)43)39(48,35(38)40)32(50-6)31(36)38/h8-11,19,23-24,26-27,29-32,35,47-48H,7,12-18H2,1-6H3/t19?,23-,24-,26+,27+,29-,30+,31-,32+,35?,36+,37-,38?,39?/m1/s1
Standard InChI (Main Layer) InChI=1S/C39H50N2O12/c1-7-40-17-36(18-51-34(46)22-10-8-9-11-25(22)41-28(44)14-19(2)33(41)45)13-12-27(49-5)38-24-15-23-26(52-20(3)42)16-37(47,29(24)30(23)53-21(4)43)39(48,35(38)40)32(50-6)31(36)38/h8-11,19,23-24,26-27,29-32,35,47-48H,7,12-18H2,1-6H3

Cluster

Phytochemical cluster No. 10
KCF-S cluster No. 166

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL507440

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Ranunculaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Delphinium nuttallianum 136334 Ranunculaceae eudicotyledons Viridiplantae