PCIDB

KNApSAcK Metabolite C00003527

Metabolite

KNApSAcK Entry

id C00003527
Name Cauloside A / (+)-Cauloside A / Hederagenin 3-O-arabinoside / Hederagenin 3-O-alpha-L-arabinopyranoside
CAS RN 17184-21-3
Standard InChI InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22-,23+,24+,25-,26-,27?,28-,31-,32-,33+,34+,35-/m0/s1
Standard InChI (Main Layer) InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 50

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL452911 CHEMBL538200

KEGG

By LinkDB C08953

CTD

By CAS RN C036411