C1=CC=C(C(=C1)[N+](=O)[O-])OC2C(C(C(C(O2)CO)O)O)O
CAS: 28347-45-7
이름: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(2-nitrophenoxy)oxane-3,4,5-triol
SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])OC2C(C(C(C(O2)CO)O)O)O

Molecular Processing

Molecular formula
C12H15NO8
Molecular weight
301.25
Exact mass
301.0798
XLogP
-1.23
TPSA
142.52
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
67.49

Supplementary Information

InChIKey: KUWPCJHYPSUOFW-YBXAARCKSA-N
동의어
NitrophenylgalactopyranosidesNITROPHENYLGALACTOSIDES28347-45-7beta-D-Galactopyranoside, nitrophenylRefChem:389153369-07-32-Nitrophenyl-beta-D-galactopyranosideONPG2-Nitrophenyl beta-D-galactopyranosideo-Nitrophenyl beta-D-galactopyranoside(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(2-nitrophenoxy)oxane-3,4,5-triol2-Nitrophenyl |A-D-galactopyranoside2-Nitrophenyl beta-D-galactosideb-D-Galactopyranoside, 2-nitrophenylMFCD00063255(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(2-nitrophenoxy)tetrahydro-2H-pyran-3,4,5-triolo-Nitrophenyl-beta-D-galactoside8RFX6AT9WP.beta.-D-Galactopyranoside, 2-nitrophenyl30677-14-6o-Nitrophenyl .beta.-galactosideo-Nitrophenyl .beta.-D-galactosideo-Nitrophenyl ?-D-Galactopyranosidebeta-D-Galactopyranoside, 2-nitrophenylGalactopyranoside, o-nitrophenyl, .beta.-D-M027311-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSEo-nitrophenyl b-d-galactopyranosideo-Nitrophenyl-beta-D-galactopyranosideo-NPG
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