Chemical Components in the PDB

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FCN : Summary

Code

FCN

One-letter code

X

Molecule name

FOSFOMYCIN

Synonyms

1,2-EPOXYPROPYLPHOSPHONIC ACID

Systematic names

ProgramVersionName
ACDLabs 10.04 [(2R,3S)-3-methyloxiran-2-yl]phosphonic acid
OpenEye OEToolkits 1.5.0 [(2R,3S)-3-methyloxiran-2-yl]phosphonic acid

Formula

C3 H7 O4 P

Formal charge

0

Molecular weight

138.059 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=P(O)(O)C1OC1C
SMILES CACTVS 3.341 C[CH]1O[CH]1[P](O)(O)=O
SMILES OpenEye OEToolkits 1.5.0 CC1C(O1)P(=O)(O)O
Canonical SMILES CACTVS 3.341 C[C@@H]1O[C@@H]1[P](O)(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C[C@H]1[C@H](O1)P(=O)(O)O

IUPAC InChI

InChI=1S/C3H7O4P/c1-2-3(7-2)8(4,5)6/h2-3H,1H3,(H2,4,5,6)/t2-,3+/m0/s1

IUPAC InChI key

YMDXZJFXQJVXBF-STHAYSLISA-N
FCN

wwPDB Information

Atom count

15 (8 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned