Products for Research Use Only
RegisterLogin

BAL30072

CAT: 1410-M16733-01Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M16733-01Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
BAL30072 is a monocyclic beta-lactam antibiotic that shows potent activity against MDR Pseudomonas aeruginosa and Acinetobacter sp.
CAS Number
941285-15-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
518.472
Molecular Formula
C16H18N6O10S2
Notes
Research use only, not for human use.
Receptor
Antibacterial

Chemical Information

Bal30072

a siderophore with antibacterial activity; structure in first source

CAS Number941285-15-0
PubChem CID52942440
IUPAC Name[(3S)-3-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[(1,5-dihydroxy-4-oxo-2-pyridinyl)methoxyimino]acetyl]amino]-2,2-dimethyl-4-oxoazetidin-1-yl] hydrogen sulfate
Molecular FormulaC16H18N6O10S2
Molecular Weight518.5
XLogP-1
Topological Polar Surface Area271
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Heavy Atom Count34
Formal Charge0
Complexity1080
SMILES
CC1([C@@H](C(=O)N1OS(=O)(=O)O)NC(=O)/C(=N\OCC2=CC(=O)C(=CN2O)O)/C3=CSC(=N3)N)C
InChI
InChI=1S/C16H18N6O10S2/c1-16(2)12(14(26)22(16)32-34(28,29)30)19-13(25)11(8-6-33-15(17)18-8)20-31-5-7-3-9(23)10(24)4-21(7)27/h3-4,6,12,24,27H,5H2,1-2H3,(H2,17,18)(H,19,25)(H,28,29,30)/b20-11-/t12-/m1/s1
InChIKey
KLFSEZJCLYBFKQ-WXYNYTDUSA-N
Chemical Structure
2D Structure
2D structure of Bal30072
CAS: 941285-15-0
CID: 52942440
Formula: C16H18N6O10S2
MW: 518.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight518.5
XLogP3-1
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Exact Mass518.05258314
Monoisotopic Mass518.05258314
Topological Polar Surface Area271 Ų
Heavy Atom Count34
Formal Charge0
Complexity1080
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3606727-01BAL30072
AR-B05924-01BAL30072 Impurity 3
AR-B05925-01BAL30072 Impurity 4
AR-B05922-01BAL30072 Impurity 1
AR-B05926-01BAL30072 Impurity 5
AR-B05923-01BAL30072 Impurity 2

Popular Products