PCIDB

KNApSAcK Metabolite C00007885

Metabolite

KNApSAcK Entry

id C00007885
Name Neosakuranin
CAS RN 31187-54-9
Standard InChI InChI=1S/C22H24O10/c1-30-13-8-15(26)18(14(25)7-4-11-2-5-12(24)6-3-11)16(9-13)31-22-21(29)20(28)19(27)17(10-23)32-22/h2-9,17,19-24,26-29H,10H2,1H3/b7-4+/t17?,19-,20+,21?,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H24O10/c1-30-13-8-15(26)18(14(25)7-4-11-2-5-12(24)6-3-11)16(9-13)31-22-21(29)20(28)19(27)17(10-23)32-22/h2-9,17,19-24,26-29H,10H2,1H3

Cluster

Phytochemical cluster No. 13
KCF-S cluster No. 36

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL495848

KEGG

By LinkDB

CTD

By CAS RN