主记录
1-NBDG
- CAS
- 2376921-70-7
- PubChem CID
- 102492674
- SMILES
- C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])N[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
- 分子式
- C12H14N4O8
- 分子量
- 342.264
- 精确分子量
- 342.0812
- InChI
- InChI=1S/C12H14N4O8/c17-3-6-9(18)10(19)11(20)12(23-6)13-4-1-2-5(16(21)22)8-7(4)14-24-15-8/h1-2,6,9-13,17-20H,3H2/t6-,9-,10+,11-,12-/m1/s1
- InChIKey
- ZXXYZPVBLJMGPU-UJDFUTJXSA-N
- LogP
- -1.6572
- TPSA
- 184.24
名称与别名
- 1-NBDG
- EX-A4323A
- J3.189.143D
- 2376921-70-7
- 4-(beta-D-Glucopyranosylamino)-7-nitro-2,1,3-benzooxadiazole
- (2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)tetrahydro-2H-pyran-3,4,5-triol
- (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]oxane-3,4,5-triol
- (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]oxane-3,4,5-triol