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Oganomycin A

CAT: 0013-GTR19255823-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19255823-01Size:10 mg
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Description
Oganomycin A exhibits resistance against both Gram-positive and Gram-negative bacteria, with a stronger inhibitory effect on Gram-negative bacteria compared to Gram-positive bacteria.
CAS Number
75794-94-4
Field of Research
Infectious Disease & Virology
Smiles
N (C (CCC[C@H] (C (O) =O) N) =O) [C@@]1 (OC) [C@@]2 (N (C1=O) C (C (O) =O) =C (COC (/C=C/C3=CC=C (OS (=O) (=O) O) C=C3) =O) CS2) [H]
Molecular Formula
C24H27N3O13S2
Molecular Weight
629.613
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Oganomycin A

Oganomycin A is a N-acyl-amino acid.

CAS Number75794-94-4
PubChem CID139589089
IUPAC Name(6S,7S)-7-[[(5R)-5-amino-5-carboxypentanoyl]amino]-7-methoxy-8-oxo-3-[[(E)-3-(4-sulfooxyphenyl)prop-2-enoyl]oxymethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular FormulaC24H27N3O13S2
Molecular Weight629.6
XLogP-2.6
Topological Polar Surface Area283
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count15
Rotatable Bond Count15
Heavy Atom Count42
Formal Charge0
Complexity1250
SMILES
CO[C@@]1([C@H]2N(C1=O)C(=C(CS2)COC(=O)/C=C/C3=CC=C(C=C3)OS(=O)(=O)O)C(=O)O)NC(=O)CCC[C@H](C(=O)O)N
InChI
InChI=1S/C24H27N3O13S2/c1-38-24(26-17(28)4-2-3-16(25)20(30)31)22(34)27-19(21(32)33)14(12-41-23(24)27)11-39-18(29)10-7-13-5-8-15(9-6-13)40-42(35,36)37/h5-10,16,23H,2-4,11-12,25H2,1H3,(H,26,28)(H,30,31)(H,32,33)(H,35,36,37)/b10-7+/t16-,23+,24+/m1/s1
InChIKey
WZUOYYCVBUQXEE-QDQQHJAUSA-N
Chemical Structure
2D Structure
2D structure of Oganomycin A
CAS: 75794-94-4
CID: 139589089
Formula: C24H27N3O13S2
MW: 629.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight629.6
XLogP3-2.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count15
Rotatable Bond Count15
Exact Mass629.09853027
Monoisotopic Mass629.09853027
Topological Polar Surface Area283 Ų
Heavy Atom Count42
Formal Charge0
Complexity1250
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N14528Oganomycin A
HY-N14529Oganomycin B
HY-N14926Oganomycin GB
HY-N14924Oganomycin GA

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