PCIDB

KNApSAcK Metabolite C00027292

Metabolite

KNApSAcK Entry

id C00027292
Name Aristoloterpenate III / (-)-Aristoloterpenate III
CAS RN 222412-32-0
Standard InChI InChI=1S/C32H31NO8/c1-19-7-4-9-20(2)13-22(14-21(17-34)10-5-8-19)41-32(35)25-16-28-31(40-18-39-28)30-23-11-6-12-27(38-3)24(23)15-26(29(25)30)33(36)37/h6,8-9,11-12,14-17,22H,4-5,7,10,13,18H2,1-3H3/b19-8-,20-9+,21-14+/t22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C32H31NO8/c1-19-7-4-9-20(2)13-22(14-21(17-34)10-5-8-19)41-32(35)25-16-28-31(40-18-39-28)30-23-11-6-12-27(38-3)24(23)15-26(29(25)30)33(36)37/h6,8-9,11-12,14-17,22H,4-5,7,10,13,18H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1255

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL505464 CHEMBL508460

KEGG

By LinkDB

CTD

By CAS RN