chempirical

Glycylprolylhydroxyproline

C12H19N3O5CAS 2239-67-0285.30 g/mol

Open in Covalent MOL file
NH2ONONHOOHO
AlcoholAmideCarboxylic acidPrimary amine

Properties

Molecular formula
C12H19N3O5
Molar mass
285.30 g/mol
Exact mass
285.1325 Da
logP
-2.02Crippen estimate
Polar surface area
124.2 Ų
H-bond donors / acceptors
3 / 5
Rotatable bonds
3
Stereocentres
S, R, Sin SMILES atom order

Identifiers

CAS number
2239-67-0
SMILES
NCC(=O)N1CCC[C@H]1C(=O)N1C[C@H](O)C[C@H]1C(=O)O
InChIKey
SZEOBSAZWJLOGY-VGMNWLOBSA-N
InChI
InChI=1S/C12H19N3O5/c13-5-10(17)14-3-1-2-8(14)11(18)15-6-7(16)4-9(15)12(19)20/h7-9,16H,1-6,13H2,(H,19,20)/t7-,8+,9+/m1/s1

Weigh it out

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

Names and synonyms

10 names
  • L-Proline, glycyl-L-prolyl-4-hydroxy-, (4R)-
  • Proline, 1-(1-glycyl-L-prolyl)-4-hydroxy-, L-
  • L-Proline, 1-(1-glycyl-L-prolyl)-4-hydroxy-, trans-
  • Proline, 1-(1-glycyl-L-prolyl)-4-hydroxy-
  • L-Proline, 1-(1-glycyl-L-prolyl)-4-hydroxy-
  • 70: PN: WO03006603 SEQID: 76 claimed protein
  • 1: PN: WO2007017671 PAGE: 49 claimed protein
  • 26: PN: WO2014175556 TABLE: 5 claimed sequence
  • 9: PN: WO2017020025 SEQID: 9 claimed sequence
  • Tripeptide 29

Work with Glycylprolylhydroxyproline

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

Similar compounds

Glycyl-L-proline704-15-467 % similar 1-(2-Chloroacetyl)-L-proline23500-10-948 % similar Oxaceprol33996-33-747 % similar L-Alanyl-L-proline13485-59-144 % similar Hexapeptide-91228371-11-642 % similar 1-(1,1-Dimethylethyl) (2S,4R)-4-hydroxy-1,2-pyrrolidinedicarboxylate13726-69-742 % similar 1-(Phenylmethyl) (2S,4R)-4-hydroxy-1,2-pyrrolidinedicarboxylate13504-85-341 % similar Ac-dl-pro-oh1074-79-940 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Hc blue 233229-34-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook