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Cis-4-Hydroxy-L-proline

CAT: 0286-H17168-02Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0286-H17168-02Size:250 mg
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CAS Number
618-27-9
Synonyms
(2S,4S) - (-) -4-Hydroxy-2-pyrrolidinecarboxylic acid
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00064320
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Cis-4-Hydroxy-L-Proline

Cis-4-hydroxy-L-proline is L-Proline in which a hydrogen at the 4-position of the pyrrolidine ring is substituted by a hydroxy group (S-configuration). It has a role as a metabolite. It is a 4-hydroxyproline and a non-proteinogenic L-alpha-amino acid. It is a tautomer of a cis-4-hydroxy-L-proline zwitterion.

CAS Number618-27-9
PubChem CID440015
IUPAC Name(2S,4S)-4-hydroxypyrrolidine-2-carboxylic acid
Molecular FormulaC5H9NO3
Molecular Weight131.13
XLogP-3.3
Topological Polar Surface Area69.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity125
SMILES
C1[C@@H](CN[C@@H]1C(=O)O)O
InChI
InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4-/m0/s1
InChIKey
PMMYEEVYMWASQN-IMJSIDKUSA-N
Chemical Structure
2D Structure
2D structure of Cis-4-Hydroxy-L-Proline
CAS: 618-27-9
CID: 440015
Formula: C5H9NO3
MW: 131.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight131.13
XLogP3-3.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass131.058243149
Monoisotopic Mass131.058243149
Topological Polar Surface Area69.6 Ų
Heavy Atom Count9
Formal Charge0
Complexity125
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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