76902-49-3
N6-BENZOYL-3'-DEOXYADENOSINE
NameN6-BENZOYL-3'-DEOXYADENOSINE
1Identification
【Name】
N6-BENZOYL-3'-DEOXYADENOSINE
【CAS】
【MDL】
MFCD01630965
【English Synonyms】
【Formula】
C17 H17 N5 O4
【MolWeight】
355.352
【Inchi】
InChI=1S/C17H17N5O4/c23-7-11-6-12(24)17(26-11)22-9-20-13-14(18-8-19-15(13)22)21-16(25)10-4-2-1-3-5-10/h1-5,8-9,11-12,17,23-24H,6-7H2,(H,18,19,21,25)/t11-,12+,17+/m0/s1
【InChIKey】
InChIKey=GNPRDDYSJSKPJF-XWCIJXRUSA-N
【SMILES】
c1ccc(cc1)C(=O)Nc2c3c(ncn2)n(cn3)[C@H]4[C@@H](C[C@H](O4)CO)O
【MOL File】
N6-BENZOYL-3'-DEOXYA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:9
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N6-BENZOYL-3'-DEOXYADENOSINE.cml