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Bicyclomycin

CAT: 1299-RG-A261317-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A261317-04Size:100 mg
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CAS Number
38129-37-2
Synonyms
(1S,6R) -6-hydroxy-5-methylene-1- ((1S,2S) -1,2,3-trihydroxy-2-methylpropyl) -2-oxa-7,9-diazabicyclo[4.2.2]decane-8,10-dione
Molecular Formula
C12H18N2O7
Molecular Weight
302.28
Target Alternative Name
Bicyclomycin
Product Name Synonym
(1S,6R) -6-hydroxy-5-methylene-1- ((1S,2S) -1,2,3-trihydroxy-2-methylpropyl) -2-oxa-7,9-diazabicyclo[4.2.2]decane-8,10-dione

Chemical Information

Bicyclomycin

Bicozamycin is a commercially important azabicyclic antibiotic obtained from Streptomyces sapporonensis. It inhibits the Rho protein of E. coli. It has a role as an antibacterial agent, an antiinfective agent and an antidiarrhoeal drug. It is a bridged compound and an azabicycloalkane.

CAS Number38129-37-2
PubChem CID65807
IUPAC Name(1S,6R)-6-hydroxy-5-methylidene-1-[(1S,2S)-1,2,3-trihydroxy-2-methylpropyl]-2-oxa-7,9-diazabicyclo[4.2.2]decane-8,10-dione
Molecular FormulaC12H18N2O7
Molecular Weight302.28
XLogP-2.9
Topological Polar Surface Area148
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity510
SMILES
C[C@](CO)([C@@H]([C@@]12C(=O)N[C@@](C(=C)CCO1)(C(=O)N2)O)O)O
InChI
InChI=1S/C12H18N2O7/c1-6-3-4-21-12(7(16)10(2,19)5-15)9(18)13-11(6,20)8(17)14-12/h7,15-16,19-20H,1,3-5H2,2H3,(H,13,18)(H,14,17)/t7-,10-,11+,12-/m0/s1
InChIKey
WOUDXEYYJPOSNE-VKZDFBPFSA-N
Chemical Structure
2D Structure
2D structure of Bicyclomycin
CAS: 38129-37-2
CID: 65807
Formula: C12H18N2O7
MW: 302.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight302.28
XLogP3-2.9
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass302.11140092
Monoisotopic Mass302.11140092
Topological Polar Surface Area148 Ų
Heavy Atom Count21
Formal Charge0
Complexity510
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

Alternative Products

CatalogName
HY-122071-01Bicyclomycin
B049-5MGBicyclomycin benzoate

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