PCIDB

KNApSAcK Metabolite C00006332

Metabolite

KNApSAcK Entry

id C00006332
Name Isovitexin 4'-O-glucoside 2''-O-(E)-ferulate
CAS RN 64763-02-6
Standard InChI InChI=1S/C37H38O18/c1-50-22-10-15(2-8-18(22)40)3-9-26(43)55-36-33(48)30(45)24(13-38)53-35(36)28-20(42)12-23-27(31(28)46)19(41)11-21(52-23)16-4-6-17(7-5-16)51-37-34(49)32(47)29(44)25(14-39)54-37/h2-12,24-25,29-30,32-40,42,44-49H,13-14H2,1H3/b9-3+/t24?,25?,29-,30-,32+,33+,34?,35+,36?,37-/m1/s1
Standard InChI (Main Layer) InChI=1S/C37H38O18/c1-50-22-10-15(2-8-18(22)40)3-9-26(43)55-36-33(48)30(45)24(13-38)53-35(36)28-20(42)12-23-27(31(28)46)19(41)11-21(52-23)16-4-6-17(7-5-16)51-37-34(49)32(47)29(44)25(14-39)54-37/h2-12,24-25,29-30,32-40,42,44-49H,13-14H2,1H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 7

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN