PCIDB

KNApSAcK Metabolite C00002613

Metabolite

KNApSAcK Entry

id C00002613
Name Neoisostegane
CAS RN 87084-98-8
Standard InChI InChI=1S/C23H26O7/c1-25-18-7-12-6-13-11-30-23(24)15(13)8-17-16(14(12)9-19(18)26-2)10-20(27-3)22(29-5)21(17)28-4/h7,9-10,13,15H,6,8,11H2,1-5H3/t13-,15+/m0/s1
Standard InChI (Main Layer) InChI=1S/C23H26O7/c1-25-18-7-12-6-13-11-30-23(24)15(13)8-17-16(14(12)9-19(18)26-2)10-20(27-3)22(29-5)21(17)28-4/h7,9-10,13,15H,6,8,11H2,1-5H3

Cluster

Phytochemical cluster No. 21
KCF-S cluster No. 2159

Link

ChEMBL

By standard InChI CHEMBL483208
By standard InChI Main Layer CHEMBL483208

KEGG

By LinkDB C10707

CTD

By CAS RN C043524

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
Steganotaenia araliacea 59178 Apiaceae asterids Viridiplantae