PCIDB

KNApSAcK Metabolite C00002482

Metabolite

KNApSAcK Entry

id C00002482
Name Mammeisin / Mammea A/AA / 5,7-Dihydroxy-8-(3-methyl-2-butenyl)-6-(3-methylbutyryl)-4-phenylcoumarin
CAS RN 18483-64-2
Standard InChI InChI=1S/C25H26O5/c1-14(2)10-11-17-23(28)22(19(26)12-15(3)4)24(29)21-18(13-20(27)30-25(17)21)16-8-6-5-7-9-16/h5-10,13,15,28-29H,11-12H2,1-4H3
Standard InChI (Main Layer) InChI=1S/C25H26O5/c1-14(2)10-11-17-23(28)22(19(26)12-15(3)4)24(29)21-18(13-20(27)30-25(17)21)16-8-6-5-7-9-16/h5-10,13,15,28-29H,11-12H2,1-4H3

Cluster

Phytochemical cluster No. 17
KCF-S cluster No. 266

Link

ChEMBL

By standard InChI CHEMBL194485
By standard InChI Main Layer CHEMBL194485

KEGG

By LinkDB C09275

CTD

By CAS RN C001878