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MNP-Glc

CAT: 0013-GTR19246609-03Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19246609-03Size:250 mg
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Description
MNP-Glc is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
CAS Number
70622-80-9
Smiles
O[C@H] ([C@H] ([C@@H] ([C@H] (O1) CO) O) O) [C@@H]1OC2=C (C=C (C=C2) /C=C/[N+] ([O-]) =O) OC
Molecular Formula
C15H19NO9
Molecular Weight
357.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

MNP-Glc
CAS Number70622-80-9
PubChem CID22819573
IUPAC Name(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[2-methoxy-4-[(E)-2-nitroethenyl]phenoxy]oxane-3,4,5-triol
Molecular FormulaC15H19NO9
Molecular Weight357.31
XLogP-0.8
Topological Polar Surface Area154
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity468
SMILES
COC1=C(C=CC(=C1)/C=C/[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
InChI
InChI=1S/C15H19NO9/c1-23-10-6-8(4-5-16(21)22)2-3-9(10)24-15-14(20)13(19)12(18)11(7-17)25-15/h2-6,11-15,17-20H,7H2,1H3/b5-4+/t11-,12-,13+,14-,15-/m1/s1
InChIKey
VLHYYNTWHBRKNT-HTTKMGQHSA-N
Chemical Structure
2D Structure
2D structure of MNP-Glc
CAS: 70622-80-9
CID: 22819573
Formula: C15H19NO9
MW: 357.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight357.31
XLogP3-0.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass357.10598118
Monoisotopic Mass357.10598118
Topological Polar Surface Area154 Ų
Heavy Atom Count25
Formal Charge0
Complexity468
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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