PCIDB

KNApSAcK Metabolite C00013107

Metabolite

KNApSAcK Entry

id C00013107
Name Alatusinine / (8a)-8-(Acetyloxy)-8-deoxo-26-hydroxyevonimine
CAS RN 89945-79-9
Standard InChI InChI=1S/C38H47NO19/c1-17(40)50-16-37-30(55-21(5)44)26(52-18(2)41)25-28(54-20(4)43)38(37)36(9,49)29(27(53-19(3)42)31(37)56-22(6)45)57-33(47)34(7,48)13-12-24-23(11-10-14-39-24)32(46)51-15-35(25,8)58-38/h10-11,14,25-31,48-49H,12-13,15-16H2,1-9H3
Standard InChI (Main Layer) InChI=1S/C38H47NO19/c1-17(40)50-16-37-30(55-21(5)44)26(52-18(2)41)25-28(54-20(4)43)38(37)36(9,49)29(27(53-19(3)42)31(37)56-22(6)45)57-33(47)34(7,48)13-12-24-23(11-10-14-39-24)32(46)51-15-35(25,8)58-38/h10-11,14,25-31,48-49H,12-13,15-16H2,1-9H3

Cluster

Phytochemical cluster
KCF-S cluster No. 43

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL508998 CHEMBL501360

KEGG

By LinkDB

CTD

By CAS RN