PCIDB

KNApSAcK Metabolite C00041188

Metabolite

KNApSAcK Entry

id C00041188
Name Taxuspine C
CAS RN 38046-79-6
Standard InChI InChI=1S/C35H42O9/c1-19-26(39)18-25-29(41-21(3)36)35-20(2)27(44-28(40)15-14-24-12-10-9-11-13-24)16-17-33(35,8)30(42-22(4)37)31(43-23(5)38)34(19,35)32(25,6)7/h9-15,19,25,27,29-31H,2,16-18H2,1,3-8H3/b15-14+/t19?,25?,27-,29+,30-,31-,33-,34+,35+/m0/s1
Standard InChI (Main Layer) InChI=1S/C35H42O9/c1-19-26(39)18-25-29(41-21(3)36)35-20(2)27(44-28(40)15-14-24-12-10-9-11-13-24)16-17-33(35,8)30(42-22(4)37)31(43-23(5)38)34(19,35)32(25,6)7/h9-15,19,25,27,29-31H,2,16-18H2,1,3-8H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2860

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL329225 CHEMBL453986

KEGG

By LinkDB

CTD

By CAS RN