Fosfomycin

C3H7O4PCAS 23155-02-4138.06 g/mol

Open in Covalent MOL file
OPOHOOH
EpoxideEtherPhosphonate

Properties

Molecular formula
C3H7O4P
Molar mass
138.06 g/mol
Exact mass
138.0082 Da
Melting point
94 °C
logP
-0.09Crippen estimate
Polar surface area
70.1 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1
Stereocentres
S, Rin SMILES atom order

Hazards

Not classified as hazardous under GHS by 4 ECHA notifiers. Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
23155-02-4
SMILES
C[C@@H]1O[C@@H]1P(=O)(O)O
InChIKey
YMDXZJFXQJVXBF-STHAYSLISA-N
InChI
InChI=1S/C3H7O4P/c1-2-3(7-2)8(4,5)6/h2-3H,1H3,(H2,4,5,6)/t2-,3+/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

20 names · show all
  • Phosphonic acid, P-[(2R,3S)-3-methyl-2-oxiranyl]-
  • Phosphonic acid, (1,2-epoxypropyl)-, (1R,2S)-(-)-
  • Phosphonic acid, (3-methyloxiranyl)-, (2R-cis)-
  • Phosphonic acid, [(2R,3S)-3-methyloxiranyl]-
  • P-[(2R,3S)-3-Methyl-2-oxiranyl]phosphonic acid
  • Phosphonomycin
  • Antibiotic 833A
  • (-)-(cis-1,2-Epoxypropyl)phosphonic acid
  • (2R-Cis)-(3-Methyloxiranyl)phosphonic acid
  • (-)-(1R,2S)-(1,2-Epoxypropyl)phosphonic acid
  • Fosfonomycin
  • Fosfocina
  • Phosphomycin
  • MK 0955
  • Fosfomicin
  • Levo-phosphonomycin
  • (-)-Phosphonomycin
  • [(2R,3S)-3-Methyloxiranyl]phosphonic acid
  • Infectophos
  • ZTI 01

Work with Fosfomycin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Fosfomycin tromethamine78964-85-9Salt Fosfomycin sodium26016-99-9Salt Fosfomycin calcium26016-98-8Salt Fosfomycin calcium26472-47-9Salt

Similar compounds

Dl-1-(aminoethyl)phosphonic acid6323-97-341 % similar cis-2,3-Epoxybutane1758-33-432 % similar trans-2,3-Dimethyloxirane21490-63-132 % similar 2,3-Epoxybutane3266-23-732 % similar Bis(1-methylethyl) phosphorochloridate2574-25-631 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook