PCIDB

KNApSAcK Metabolite C00034248

Metabolite

KNApSAcK Entry

id C00034248
Name Shizukaol B / (-)-Shizukaol B
CAS RN 142279-40-1
Standard InChI InChI=1S/C40H44O13/c1-16-7-6-8-27(41)51-14-28(42)50-13-20-22-12-25-37(3,23-11-24(23)39(25,48)15-52-34(16)45)26-10-19-18-9-21(18)38(4)30(19)31(40(22,26)53-36(20)47)29(32(43)33(38)44)17(2)35(46)49-5/h7,18,21,23-26,31,33,44,48H,6,8-15H2,1-5H3/b16-7+,29-17-/t18-,21-,23-,24+,25?,26+,31?,33+,37+,38+,39+,40+/m1/s1
Standard InChI (Main Layer) InChI=1S/C40H44O13/c1-16-7-6-8-27(41)51-14-28(42)50-13-20-22-12-25-37(3,23-11-24(23)39(25,48)15-52-34(16)45)26-10-19-18-9-21(18)38(4)30(19)31(40(22,26)53-36(20)47)29(32(43)33(38)44)17(2)35(46)49-5/h7,18,21,23-26,31,33,44,48H,6,8-15H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 944

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

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CTD

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