PCIDB

KNApSAcK Metabolite C00040784

Metabolite

KNApSAcK Entry

id C00040784
Name 1-Dehydroxybaccatin VI / (-)-1-Dehydroxybaccatin VI
CAS RN 125037-14-1
Standard InChI InChI=1S/C37H46O13/c1-18-26(45-19(2)38)15-25-30(49-34(43)24-13-11-10-12-14-24)32-36(9,27(46-20(3)39)16-28-37(32,17-44-28)50-23(6)42)33(48-22(5)41)31(47-21(4)40)29(18)35(25,7)8/h10-14,25-28,30-33H,15-17H2,1-9H3/t25-,26-,27-,28+,30+,31+,32-,33-,36+,37-/m0/s1
Standard InChI (Main Layer) InChI=1S/C37H46O13/c1-18-26(45-19(2)38)15-25-30(49-34(43)24-13-11-10-12-14-24)32-36(9,27(46-20(3)39)16-28-37(32,17-44-28)50-23(6)42)33(48-22(5)41)31(47-21(4)40)29(18)35(25,7)8/h10-14,25-28,30-33H,15-17H2,1-9H3

Cluster

Phytochemical cluster
KCF-S cluster No. 307

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1991151

KEGG

By LinkDB

CTD

By CAS RN C062549