PCIDB

KNApSAcK Metabolite C00019793

Metabolite

KNApSAcK Entry

id C00019793
Name Hymexelsin / Xeroboside / 7-O-beta-Apiofuranosyl-(1->6)-beta-glucopyranosylscopoletin / 7-O-[beta-D-Apiofuranosyl-(1->6)-beta-D-glucopyranosyl]-6-methoxycoumarin
CAS RN 117842-09-8
Standard InChI InChI=1S/C21H26O13/c1-29-10-4-8-2-3-14(23)31-9(8)5-11(10)32-21-19(28)17(26)16(25)13(34-21)7-30-20-18(27)15(24)12(6-22)33-20/h2-5,12-13,15-22,24-28H,6-7H2,1H3/t12-,13?,15?,16-,17+,18+,19?,20-,21-/m1/s1
Standard InChI (Main Layer) InChI=1S/C21H26O13/c1-29-10-4-8-2-3-14(23)31-9(8)5-11(10)32-21-19(28)17(26)16(25)13(34-21)7-30-20-18(27)15(24)12(6-22)33-20/h2-5,12-13,15-22,24-28H,6-7H2,1H3

Cluster

Phytochemical cluster No. 25
KCF-S cluster No. 2330

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN