PCIDB

KNApSAcK Metabolite C00025323

Metabolite

KNApSAcK Entry

id C00025323
Name Michellamine B / (-)-Michellamine B
CAS RN 137893-48-2
Standard InChI InChI=1S/C46H48N2O8/c1-19-9-25-27(41-31-13-21(3)47-23(5)39(31)33(49)17-35(41)51)15-29(45(53)43(25)37(11-19)55-7)30-16-28(26-10-20(2)12-38(56-8)44(26)46(30)54)42-32-14-22(4)48-24(6)40(32)34(50)18-36(42)52/h9-12,15-18,21-24,47-54H,13-14H2,1-8H3/t21-,22-,23-,24-/m1/s1
Standard InChI (Main Layer) InChI=1S/C46H48N2O8/c1-19-9-25-27(41-31-13-21(3)47-23(5)39(31)33(49)17-35(41)51)15-29(45(53)43(25)37(11-19)55-7)30-16-28(26-10-20(2)12-38(56-8)44(26)46(30)54)42-32-14-22(4)48-24(6)40(32)34(50)18-36(42)52/h9-12,15-18,21-24,47-54H,13-14H2,1-8H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1325

Link

ChEMBL

By standard InChI CHEMBL295292
By standard InChI Main Layer CHEMBL295292 CHEMBL325222 CHEMBL1621732

KEGG

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CTD

By CAS RN