Alpha-guanidinoglutaric acid

C₆H₁₁N₃O₄CAS 73477-53-9189.17 g/mol

Open in Covalent MOL file

Carboxylic acid Guanidine

Properties

Molecular formula: C₆H₁₁N₃O₄
Molar mass: 189.17 g/mol
Exact mass: 189.0750 Da
logP: -1.42Crippen estimate
Polar surface area: 139.0 Å²
H-bond donors / acceptors: 4 / 3
Rotatable bonds: 5
Stereocentres: Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

73477-53-9

SMILES

C(CC(=O)O)[C@@H](C(=O)O)N=C(N)N

InChIKey

RHVVRMJOHATSPD-VKHMYHEASA-N

InChI

InChI=1S/C6H11N3O4/c7-6(8)9-3(5(12)13)1-2-4(10)11/h3H,1-2H2,(H,10,11)(H,12,13)(H4,7,8,9)/t3-/m0/s1

Weigh it out

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

Work with Alpha-guanidinoglutaric acid

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-glutamic acid7412-78-465 % similar N-Acetyl-L-glutamic acid1188-37-064 % similar N-Acetylglutamic acid5817-08-364 % similar Pyroglutamic acid149-87-153 % similar (+)-Pyroglutamic acid4042-36-853 % similar L-Pyroglutamic acid98-79-353 % similar Poly(L-glutamic acid)25513-46-651 % similar Glutamic acid56-86-051 % similar

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

Same formula

Glycyl-D-asparagine24667-21-8 Glycylglycylglycine556-33-2

Elsewhere

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