PCIDB

KNApSAcK Metabolite C00035039

Metabolite

KNApSAcK Entry

id C00035039
Name Aegicerin
CAS RN 2749-23-7
Standard InChI InChI=1S/C30H48O3/c1-24(2)14-15-29-18-33-30(21(29)16-24)13-9-20-26(5)11-10-22(31)25(3,4)19(26)8-12-27(20,6)28(30,7)17-23(29)32/h19-22,31H,8-18H2,1-7H3/t19-,20+,21+,22-,26-,27+,28-,29+,30-/m0/s1
Standard InChI (Main Layer) InChI=1S/C30H48O3/c1-24(2)14-15-29-18-33-30(21(29)16-24)13-9-20-26(5)11-10-22(31)25(3,4)19(26)8-12-27(20,6)28(30,7)17-23(29)32/h19-22,31H,8-18H2,1-7H3

Cluster

Phytochemical cluster No. 52
KCF-S cluster No. 101

Link

ChEMBL

By standard InChI CHEMBL522394
By standard InChI Main Layer CHEMBL522394

KEGG

By LinkDB

CTD

By CAS RN