PCIDB

KNApSAcK Metabolite C00025224

Metabolite

KNApSAcK Entry

id C00025224
Name Voacangine hydroxyindolenine / 7alpha-Hydroxyvoacangine indolenine
CAS RN 3464-63-9
Standard InChI InChI=1S/C22H28N2O4/c1-4-14-9-13-11-21(20(25)28-3)18(14)24(12-13)8-7-22(26)16-10-15(27-2)5-6-17(16)23-19(21)22/h5-6,10,13-14,18,26H,4,7-9,11-12H2,1-3H3/t13-,14+,18+,21+,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H28N2O4/c1-4-14-9-13-11-21(20(25)28-3)18(14)24(12-13)8-7-22(26)16-10-15(27-2)5-6-17(16)23-19(21)22/h5-6,10,13-14,18,26H,4,7-9,11-12H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1560

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL488201

KEGG

By LinkDB

CTD

By CAS RN