Glycyl-L-aspartic acid

C₆H₁₀N₂O₅CAS 4685-12-5190.15 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine

Properties

Molecular formula: C₆H₁₀N₂O₅
Molar mass: 190.15 g/mol
Exact mass: 190.0590 Da
logP: -1.17Crippen estimate
Polar surface area: 133.2 Å²
H-bond donors / acceptors: 4 / 4
Rotatable bonds: 5
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

4685-12-5

SMILES

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

InChIKey

SCCPDJAQCXWPTF-VKHMYHEASA-N

InChI

InChI=1S/C6H10N2O5/c7-2-4(9)8-3(6(12)13)1-5(10)11/h3H,1-2,7H2,(H,8,9)(H,10,11)(H,12,13)/t3-/m0/s1

Weigh it out

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

Names and synonyms

14 names · show all

L-Aspartic acid, glycyl-
Aspartic acid, N-glycyl-, L-
L-Aspartic acid, N-glycyl-
N-Glycylaspartic acid
Glycylaspartic acid
N-Glycyl-L-aspartic acid
43: PN: EP2161028 PAGE: 10 claimed protein
61: PN: WO2011146121 PAGE: 115 claimed sequence
116: PN: WO2012050923 SEQID: 143 unclaimed protein
(S)-2-(2-Aminoacetamido)succinic acid
(2S)-2-[(2-Aminoacetyl)amino]butanedioic acid
6: PN: WO2020046069 SEQID: 7 claimed protein
4: PN: KR20200025906 SEQID: 4 claimed sequence
13: PN: WO2021055880 SEQID: 14 claimed protein

Work with Glycyl-L-aspartic 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 acid7412-78-472 % similar Glycylserine687-38-766 % similar Glycylleucine688-14-261 % similar Glycyl-L-leucine869-19-261 % similar N-Acetylaspartic acid2545-40-657 % similar N-Acetyl-L-aspartic acid997-55-757 % similar Glycyl-L-glutamine13115-71-456 % similar Glycylphenylalanine3321-03-756 % similar

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

Same formula

Carbamylglutamic acid1188-38-1 Ada (buffer)26239-55-4

Elsewhere

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