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Olivanic acid

CAT: 0931-TN11279-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN11279-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
64761-66-6
Target
Antibiotic, Antibacterial
Related Pathways
Microbiology/Virology
Bioactivity
Olivanic acid is a β-lactam antibiotic with activity against both Gram-positive and Gram-negative bacteria, and it inhibits β-lactamase.
Smiles
O=C(O)C1=C(SC=CN)CC2N1C(=O)C2C(O)C
Molecular Formula
C11H14N2O4S
Molecular Weight
270.31
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Olivanic acid

Olivanic acid has been reported in Streptomyces argenteolus, Streptomyces olivaceus, and Streptomyces griseus with data available.

CAS Number64761-66-6
PubChem CID6438396
IUPAC Name3-[(E)-2-aminoethenyl]sulfanyl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Molecular FormulaC11H14N2O4S
Molecular Weight270.31
XLogP-0.3
Topological Polar Surface Area129
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity460
SMILES
CC(C1C2CC(=C(N2C1=O)C(=O)O)S/C=C/N)O
InChI
InChI=1S/C11H14N2O4S/c1-5(14)8-6-4-7(18-3-2-12)9(11(16)17)13(6)10(8)15/h2-3,5-6,8,14H,4,12H2,1H3,(H,16,17)/b3-2+
InChIKey
HFTVKHFILHLXJF-NSCUHMNNSA-N
Chemical Structure
2D Structure
2D structure of Olivanic acid
CAS: 64761-66-6
CID: 6438396
Formula: C11H14N2O4S
MW: 270.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight270.31
XLogP3-0.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass270.06742811
Monoisotopic Mass270.06742811
Topological Polar Surface Area129 Ų
Heavy Atom Count18
Formal Charge0
Complexity460
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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