PCIDB

KNApSAcK Metabolite C00033529

Metabolite

KNApSAcK Entry

id C00033529
Name 14-Hydroxyhypocretenolide-beta-D-glucopyranoside
CAS RN 116359-92-3
Standard InChI InChI=1S/C21H26O9/c1-9-5-13(23)15-12(4-3-11-6-21(9,15)30-19(27)10(11)2)8-28-20-18(26)17(25)16(24)14(7-22)29-20/h5,11,14,16-18,20,22,24-26H,2-4,6-8H2,1H3/t11-,14-,16-,17+,18-,20?,21+/m1/s1
Standard InChI (Main Layer) InChI=1S/C21H26O9/c1-9-5-13(23)15-12(4-3-11-6-21(9,15)30-19(27)10(11)2)8-28-20-18(26)17(25)16(24)14(7-22)29-20/h5,11,14,16-18,20,22,24-26H,2-4,6-8H2,1H3

Cluster

Phytochemical cluster
KCF-S cluster No. 212

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL523310

KEGG

By LinkDB

CTD

By CAS RN