PCIDB

KNApSAcK Metabolite C00030705

Metabolite

KNApSAcK Entry

id C00030705
Name Macrophyllic acid
CAS RN 2785-58-2
Standard InChI InChI=1S/C40H54O6/c1-21(2)31-23-11-13-29-37(5,15-9-17-39(29,7)35(43)44)27(23)19-25(33(31)41)26-20-28-24(32(22(3)4)34(26)42)12-14-30-38(28,6)16-10-18-40(30,8)36(45)46/h19-22,29-30,41-42H,9-18H2,1-8H3,(H,43,44)(H,45,46)
Standard InChI (Main Layer) InChI=1S/C40H54O6/c1-21(2)31-23-11-13-29-37(5,15-9-17-39(29,7)35(43)44)27(23)19-25(33(31)41)26-20-28-24(32(22(3)4)34(26)42)12-14-30-38(28,6)16-10-18-40(30,8)36(45)46/h19-22,29-30,41-42H,9-18H2,1-8H3,(H,43,44)(H,45,46)

Cluster

Phytochemical cluster
KCF-S cluster No. 5759

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

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CTD

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