PCIDB

KNApSAcK Metabolite C00002272

Metabolite

KNApSAcK Entry

id C00002272
Name Zygadenine
CAS RN 545-45-9
Standard InChI InChI=1S/C27H43NO7/c1-13-4-7-18-24(3,32)20-14(12-28(18)11-13)15-10-25-17(26(15,33)22(31)21(20)30)6-5-16-23(25,2)9-8-19(29)27(16,34)35-25/h13-22,29-34H,4-12H2,1-3H3/t13-,14-,15-,16-,17+,18-,19-,20+,21+,22-,23-,24+,25+,26-,27-/m0/s1
Standard InChI (Main Layer) InChI=1S/C27H43NO7/c1-13-4-7-18-24(3,32)20-14(12-28(18)11-13)15-10-25-17(26(15,33)22(31)21(20)30)6-5-16-23(25,2)9-8-19(29)27(16,34)35-25/h13-22,29-34H,4-12H2,1-3H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 607

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C10831

CTD

By CAS RN