PCIDB

KNApSAcK Metabolite C00001516

Metabolite

KNApSAcK Entry

id C00001516
Name alpha-Amanitin
CAS RN 23109-05-9
Standard InChI InChI=1S/C39H54N10O14S/c1-4-16(2)30-36(60)43-11-28(54)44-25-15-64(63)38-21(20-6-5-18(51)7-23(20)46-38)9-24(33(57)42-12-29(55)47-30)45-37(61)31(17(3)27(53)14-50)48-35(59)26-8-19(52)13-49(26)39(62)22(32(40)56)10-41-34(25)58/h5-7,16-17,19,22,24-27,30-31,46,50-53H,4,8-15H2,1-3H3,(H2,40,56)(H,41,58)(H,42,57)(H,43,60)(H,44,54)(H,45,61)(H,47,55)(H,48,59)/t16-,17-,19+,22?,24-,25-,26-,27-,30-,31-,64+/m0/s1
Standard InChI (Main Layer) InChI=1S/C39H54N10O14S/c1-4-16(2)30-36(60)43-11-28(54)44-25-15-64(63)38-21(20-6-5-18(51)7-23(20)46-38)9-24(33(57)42-12-29(55)47-30)45-37(61)31(17(3)27(53)14-50)48-35(59)26-8-19(52)13-49(26)39(62)22(32(40)56)10-41-34(25)58/h5-7,16-17,19,22,24-27,30-31,46,50-53H,4,8-15H2,1-3H3,(H2,40,56)(H,41,58)(H,42,57)(H,43,60)(H,44,54)(H,45,61)(H,47,55)(H,48,59)

Cluster

Phytochemical cluster
KCF-S cluster No. 3240

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C08438

CTD

By CAS RN