PCIDB

KNApSAcK Metabolite C00047923

Metabolite

KNApSAcK Entry

id C00047923
Name Hirsein B
CAS RN 1127258-68-7
Standard InChI InChI=1S/C39H50O11/c1-6-7-8-9-10-11-12-19-36-48-33-29-32-35(21-40,47-32)34(44)37(45)27(20-23(4)30(37)43)39(29,50-36)24(5)31(38(33,49-36)22(2)3)46-28(42)18-15-25-13-16-26(41)17-14-25/h13-18,20,24,27,29,31-34,40-41,44-45H,2,6-12,19,21H2,1,3-5H3/b18-15+/t24-,27-,29+,31-,32+,33-,34-,35+,36-,37-,38+,39+/m1/s1
Standard InChI (Main Layer) InChI=1S/C39H50O11/c1-6-7-8-9-10-11-12-19-36-48-33-29-32-35(21-40,47-32)34(44)37(45)27(20-23(4)30(37)43)39(29,50-36)24(5)31(38(33,49-36)22(2)3)46-28(42)18-15-25-13-16-26(41)17-14-25/h13-18,20,24,27,29,31-34,40-41,44-45H,2,6-12,19,21H2,1,3-5H3

Cluster

Phytochemical cluster No. 41
KCF-S cluster No. 401

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL562784

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Thymelaeaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Thymelaea hirsuta 69845 Thymelaeaceae rosids Viridiplantae