Catalog Number:
AG009EPK
Chemical Name:
Plerixafor-d4
CAS Number:
1246819-87-3
Molecular Formula:
C28H50D4N8
Molecular Weight:
506.8066
MDL Number:
MFCD19705148
IUPAC Name:
1-[[2,3,5,6-tetradeuterio-4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane
InChI:
InChI=1S/C28H54N8/c1-9-29-15-17-31-13-3-21-35(23-19-33-11-1)25-27-5-7-28(8-6-27)26-36-22-4-14-32-18-16-30-10-2-12-34-20-24-36/h5-8,29-34H,1-4,9-26H2/i5D,6D,7D,8D
InChI Key:
YIQPUIGJQJDJOS-KDWZCNHSSA-N
SMILES:
c1([2H])c(CN2CCNCCCNCCNCCC2)c([2H])c(c(c1[2H])CN1CCNCCCNCCNCCC1)[2H]
