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Methyl-Alpha-L-acosamine

CAT: 0572-TRC-M275500-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M275500-25MGSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
54623-23-3
Hazard Statement
Not a hazardous substance according to GHS.
Smiles
CO[C@H]1C[C@H](N)[C@@H](O)[C@H](C)O1
Molecular Formula
C7 H15 N O3
Molecular Weight
161.2
InChI
InChI=1S/C7H15NO3/c1-4-7(9)5(8)3-6(10-2)11-4/h4-7,9H,3,8H2,1-2H3/t4-,5-,6+,7-/m0/s1
Additionnal Information
IUPAC name: (2S,3R,4S,6R)-4-amino-6-methoxy-2-methyloxan-3-ol
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Methyl-3-amino-2,3,6-trideoxy-alpha-L-arabino-hexopyranoside

structural analog of daunosamine; structure

CAS Number54623-23-3
PubChem CID99464
IUPAC Name(2S,3R,4S,6R)-4-amino-6-methoxy-2-methyloxan-3-ol
Molecular FormulaC7H15NO3
Molecular Weight161.20
XLogP-0.8
Topological Polar Surface Area64.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity131
SMILES
C[C@H]1[C@@H]([C@H](C[C@@H](O1)OC)N)O
InChI
InChI=1S/C7H15NO3/c1-4-7(9)5(8)3-6(10-2)11-4/h4-7,9H,3,8H2,1-2H3/t4-,5-,6+,7-/m0/s1
InChIKey
UIWJWFKPPXKEJV-YTLHQDLWSA-N
Chemical Structure
2D Structure
2D structure of Methyl-3-amino-2,3,6-trideoxy-alpha-L-arabino-hexopyranoside
CAS: 54623-23-3
CID: 99464
Formula: C7H15NO3
MW: 161.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight161.20
XLogP3-0.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass161.10519334
Monoisotopic Mass161.10519334
Topological Polar Surface Area64.7 Ų
Heavy Atom Count11
Formal Charge0
Complexity131
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes