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Neoagarobiose

CAT: 0804-HY-121322Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-121322Size:1 Each
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Description
Neoagarobiose has both a moisturizing effect on skin and a whitening effect on melanoma cells. RagaA11 is an endo-type beta-agarase hydrolysing not only agarose, but also neoagarotetraose, to yield neoagarobiose as the final main product[1].
CAS Number
484-58-2
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/neoagarobiose.html
Smiles
OC[C@@H](O)[C@H](O)[C@]([C@@H](O)C=O)([H])O[C@H]1[C@H]([C@H]2[C@@](O)([H])[C@H](CO2)O1)O
Molecular Formula
C12H20O10
Molecular Weight
324.28
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Ohta Y, et al. High-level expression of a neoagarobiose-producing beta-agarase gene from Agarivorans sp. JAMB-A11 in Bacillus subtilis and enzymic properties of the recombinant enzyme. Biotechnol Appl Biochem. 2005 Apr;41 (Pt 2) :183-91.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Neoagarobiose

RN given refers to neoagarobiose, (D-Gal-L-Galp)-isomer; structure given in first source

CAS Number484-58-2
PubChem CID164618
IUPAC Name(2R,3S,4S,5R)-3-[[(1S,3S,4S,5R)-4,8-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-2,4,5,6-tetrahydroxyhexanal
Molecular FormulaC12H20O10
Molecular Weight324.28
XLogP-4.6
Topological Polar Surface Area166
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Heavy Atom Count22
Formal Charge0
Complexity379
SMILES
C1[C@H]2C([C@@H](O1)[C@@H]([C@@H](O2)O[C@H]([C@H](C=O)O)[C@H]([C@@H](CO)O)O)O)O
InChI
InChI=1S/C12H20O10/c13-1-4(15)7(17)10(5(16)2-14)22-12-9(19)11-8(18)6(21-12)3-20-11/h2,4-13,15-19H,1,3H2/t4-,5+,6+,7+,8?,9+,10-,11-,12+/m1/s1
InChIKey
ILLZAAKBNPACJI-UOFVWDQCSA-N
Chemical Structure
2D Structure
2D structure of Neoagarobiose
CAS: 484-58-2
CID: 164618
Formula: C12H20O10
MW: 324.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.28
XLogP3-4.6
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Exact Mass324.10564683
Monoisotopic Mass324.10564683
Topological Polar Surface Area166 Ų
Heavy Atom Count22
Formal Charge0
Complexity379
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5783171Neoagarobiose

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