PCIDB

KNApSAcK Metabolite C00003690

Metabolite

KNApSAcK Entry

id C00003690
Name Cucurbitacin J
CAS RN 5979-41-9
Standard InChI InChI=1S/C30H44O8/c1-25(2)15-9-10-19-27(5)13-18(32)23(30(8,38)21(34)12-20(33)26(3,4)37)28(27,6)14-22(35)29(19,7)16(15)11-17(31)24(25)36/h9,11,16,18-20,23,31-33,37-38H,10,12-14H2,1-8H3/t16-,18-,19+,20?,23+,27+,28-,29+,30+/m1/s1
Standard InChI (Main Layer) InChI=1S/C30H44O8/c1-25(2)15-9-10-19-27(5)13-18(32)23(30(8,38)21(34)12-20(33)26(3,4)37)28(27,6)14-22(35)29(19,7)16(15)11-17(31)24(25)36/h9,11,16,18-20,23,31-33,37-38H,10,12-14H2,1-8H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 220

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1923789 CHEMBL1923790 CHEMBL1984707

KEGG

By LinkDB C08801

CTD

By CAS RN