PCIDB

KNApSAcK Metabolite C00003414

Metabolite

KNApSAcK Entry

id C00003414
Name Clerodendrin A
CAS RN 35481-70-0
Standard InChI InChI=1S/C31H42O12/c1-8-28(6,43-19(5)34)27(36)42-25-21(35)13-22-29(7,23-12-20-9-10-37-26(20)41-23)16(2)11-24(40-18(4)33)30(22,14-38-17(3)32)31(25)15-39-31/h9-11,20-26,35H,8,12-15H2,1-7H3/t20-,21-,22-,23+,24+,25+,26+,28-,29+,30+,31-/m1/s1
Standard InChI (Main Layer) InChI=1S/C31H42O12/c1-8-28(6,43-19(5)34)27(36)42-25-21(35)13-22-29(7,23-12-20-9-10-37-26(20)41-23)16(2)11-24(40-18(4)33)30(22,14-38-17(3)32)31(25)15-39-31/h9-11,20-26,35H,8,12-15H2,1-7H3

Cluster

Phytochemical cluster No. 43
KCF-S cluster No. 2611

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C09074

CTD

By CAS RN