108310-90-3
5'-O-(DIMETHOXYTRITYL)-2'-DEOXYNEBULARINE
Name5'-O-(DIMETHOXYTRITYL)-2'-DEOXYNEBULARINE
1Identification
【Name】
5'-O-(DIMETHOXYTRITYL)-2'-DEOXYNEBULARINE
【CAS】
【MDL】
MFCD01630991
【English Synonyms】
【Formula】
C31 H30 N4 O5
【MolWeight】
538.601
【Inchi】
InChI=1S/C31H30N4O5/c1-37-24-12-8-22(9-13-24)31(21-6-4-3-5-7-21,23-10-14-25(38-2)15-11-23)39-18-28-27(36)16-29(40-28)35-20-34-26-17-32-19-33-30(26)35/h3-15,17,19-20,27-29,36H,16,18H2,1-2H3/t27-,28+,29+/m0/s1
【InChIKey】
InChIKey=NYJZTPKLBIEHRX-ZGIBFIJWSA-N
【SMILES】
COc1ccc(cc1)C(c2ccccc2)(c3ccc(cc3)OC)OC[C@@H]4[C@H](C[C@@H](O4)n5cnc6c5ncnc6)O
【MOL File】
5'-O-(DIMETHOXYTRITY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:9
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5'-O-(DIMETHOXYTRITYL)-2'-DEOXYNEBULARINE.cml