PCIDB

KNApSAcK Metabolite C00036709

Metabolite

KNApSAcK Entry

id C00036709
Name alpha-Amyrin acetate
CAS RN 863-76-3
Standard InChI InChI=1S/C32H52O2/c1-20-12-15-29(6)18-19-31(8)23(27(29)21(20)2)10-11-25-30(7)16-14-26(34-22(3)33)28(4,5)24(30)13-17-32(25,31)9/h10,20-21,24-27H,11-19H2,1-9H3/t20-,21+,24+,25-,26+,27+,29-,30+,31-,32-/m1/s1
Standard InChI (Main Layer) InChI=1S/C32H52O2/c1-20-12-15-29(6)18-19-31(8)23(27(29)21(20)2)10-11-25-30(7)16-14-26(34-22(3)33)28(4,5)24(30)13-17-32(25,31)9/h10,20-21,24-27H,11-19H2,1-9H3

Cluster

Phytochemical cluster
KCF-S cluster No. 177

Link

ChEMBL

By standard InChI CHEMBL471754
By standard InChI Main Layer CHEMBL471754

KEGG

By LinkDB

CTD

By CAS RN C000265