869355-16-8
5'-O-(4,4'-DIMETHOXYTRITYL)-7-DEAZA-2'-DEOXYXANTHOSINE
Name5'-O-(4,4'-DIMETHOXYTRITYL)-7-DEAZA-2'-DEOXYXANTHOSINE
1Identification
【Name】
5'-O-(4,4'-DIMETHOXYTRITYL)-7-DEAZA-2'-DEOXYXANTHOSINE
【CAS】
【MDL】
MFCD04973667
【English Synonyms】
【Formula】
C32 H31 N3 O7
【MolWeight】
569.611
【Inchi】
InChI=1S/C32H31N3O7/c1-39-23-12-8-21(9-13-23)32(20-6-4-3-5-7-20,22-10-14-24(40-2)15-11-22)41-19-27-26(36)18-28(42-27)35-17-16-25-29(35)33-31(38)34-30(25)37/h3-17,26-28,36H,18-19H2,1-2H3,(H2,33,34,37,38)/t26-,27+,28+/m0/s1
【InChIKey】
InChIKey=GBRCVBCLGPKOIS-UPRLRBBYSA-N
【SMILES】
COc1ccc(cc1)C(c2ccccc2)(c3ccc(cc3)OC)OC[C@@H]4[C@H](C[C@@H](O4)n5ccc6c5[nH]c(=O)[nH]c6=O)O
【MOL File】
5'-O-(4,4'-DIMETHOXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:10
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5'-O-(4,4'-DIMETHOXYTRITYL)-7-DEAZA-2'-DEOXYXANTHOSINE.cml