PCIDB

KNApSAcK Metabolite C00003601

Metabolite

KNApSAcK Entry

id C00003601
Name alpha-Antiarin
CAS RN 23605-05-2
Standard InChI InChI=1S/C29H42O11/c1-14-22(33)23(34)24(35)25(39-14)40-16-3-6-27(13-30)19-10-20(31)26(2)17(15-9-21(32)38-12-15)5-8-29(26,37)18(19)4-7-28(27,36)11-16/h9,13-14,16-20,22-25,31,33-37H,3-8,10-12H2,1-2H3/t14?,16-,17+,18+,19-,20+,22-,23-,24?,25-,26-,27-,28-,29-/m0/s1
Standard InChI (Main Layer) InChI=1S/C29H42O11/c1-14-22(33)23(34)24(35)25(39-14)40-16-3-6-27(13-30)19-10-20(31)26(2)17(15-9-21(32)38-12-15)5-8-29(26,37)18(19)4-7-28(27,36)11-16/h9,13-14,16-20,22-25,31,33-37H,3-8,10-12H2,1-2H3

Cluster

Phytochemical cluster No. 56
KCF-S cluster No. 109

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1169680 CHEMBL1169681 CHEMBL1169683

KEGG

By LinkDB C08847

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Moraceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Antiaris toxicaria 241857 Moraceae rosids Viridiplantae