Record Information
Version1.0
StatusDetected and Quantified
Creation Date2022-06-17 20:18:52 UTC
Update Date2022-08-12 20:09:37 UTC
Metabolite IDMMDBc0056181
Metabolite Identification
Common NameN(3)-fumaramoyl-(S)-2,3-diaminopropanoic acid
DescriptionN(beta)-Fumarylcarboxyamido-2,3-diaminopropionic acid, also known as (2E)-4-[[(2S)-2-amino-2-carboxyethyl]amino]-4-oxobut-2-enoate or N(3)-fumaramoyl-(S)-2,3-diaminopropanoate, belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom. Based on a literature review a significant number of articles have been published on N(beta)-Fumarylcarboxyamido-2,3-diaminopropionic acid.
Structure
Synonyms
ValueSource
(2E)-4-[[(2S)-2-Amino-2-carboxyethyl]amino]-4-oxobut-2-enoateChEBI
N(3)-Fumaramoyl-(S)-2,3-diaminopropanoateChEBI
(2E)-4-[[(2S)-2-Amino-2-carboxyethyl]amino]-4-oxobut-2-enoic acidGenerator
N(3)-Fumaramoyl-(S)-2,3-diaminopropanoic acidGenerator
N(b)-Fumarylcarboxyamido-2,3-diaminopropionateGenerator
N(b)-Fumarylcarboxyamido-2,3-diaminopropionic acidGenerator
N(beta)-Fumarylcarboxyamido-2,3-diaminopropionateGenerator
N(Β)-fumarylcarboxyamido-2,3-diaminopropionateGenerator
N(Β)-fumarylcarboxyamido-2,3-diaminopropionic acidGenerator
N beta-Furmarylcarboxyamido-2,3-diaminopropionic acidMeSH
FCDPMeSH
Molecular FormulaC7H11N3O4
Average Mass201.182
Monoisotopic Mass201.074955846
IUPAC Name(2S)-2-amino-3-{[(2E)-1-hydroxy-3-(C-hydroxycarbonimidoyl)prop-2-en-1-ylidene]amino}propanoic acid
Traditional Name(2S)-2-amino-3-{[(2E)-1-hydroxy-3-(C-hydroxycarbonimidoyl)prop-2-en-1-ylidene]amino}propanoic acid
CAS Registry NumberNot Available
SMILES
[H]\C(=C(\[H])C(O)=NC[C@]([H])(N)C(O)=O)C(O)=N
InChI Identifier
InChI=1S/C7H11N3O4/c8-4(7(13)14)3-10-6(12)2-1-5(9)11/h1-2,4H,3,8H2,(H2,9,11)(H,10,12)(H,13,14)/b2-1+/t4-/m0/s1
InChI KeyTXNRYTCUNXUNFH-QPHDTYRISA-N