PCIDB

KNApSAcK Metabolite C00037592

Metabolite

KNApSAcK Entry

id C00037592
Name Pabularin B / (-)-Pabularin B
CAS RN 474777-01-0
Standard InChI InChI=1S/C28H30O13/c1-13-24(16(30)7-9-35-13)40-27-26(23(34)22(33)19(11-29)39-27)41-28(2,3)20(31)12-37-25-14-4-5-21(32)38-18(14)10-17-15(25)6-8-36-17/h4-10,19-20,22-23,26-27,29,31,33-34H,11-12H2,1-3H3/t19-,20?,22-,23+,26-,27+/m1/s1
Standard InChI (Main Layer) InChI=1S/C28H30O13/c1-13-24(16(30)7-9-35-13)40-27-26(23(34)22(33)19(11-29)39-27)41-28(2,3)20(31)12-37-25-14-4-5-21(32)38-18(14)10-17-15(25)6-8-36-17/h4-10,19-20,22-23,26-27,29,31,33-34H,11-12H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2867

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
Apiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Prangos pabularia 52497 Apiaceae asterids Viridiplantae