2-((2-Amino-2-carboxyethyl)thio)tryptophan structure

2-((2-Amino-2-carboxyethyl)thio)tryptophan

(2S)-2-amino-3-[2-(2-amino-2-carboxyethyl)sulfanyl-1H-indol-3-yl]propanoic acid

Also Known As: Gravitol(e)|2-((2-Amino-2-carboxyethyl)thio)tryptophan|2-[(2-amino-2-carboxyethyl)sulfanyl]-l-tryptophan|Tryptophan, 2-((2-amino-2-carboxyethyl)thio)-|2-[(2-Amino-2-carboxyethyl)sulfanyl]tryptophan|(2S)-2-amino-3-[2-(2-amino-2-carboxyethyl)sulfanyl-1H-indol-3-yl]propanoic acid|(2S)-2-amino-3-[2-(2-amino-3-hydroxy-3-oxopropyl)sulfanyl-1H-indol-3-yl]propanoic acid|2-amino-3-[[3-[(2S)-2-amino-2-carboxy-ethyl]-1H-indol-2-yl]sulfanyl]propanoic acid

CAS: 6336-74-9
Molecular Formula C14H17N3O4S
Molecular Weight 323.09396 g/mol
LogP -4.0
Topological Polar Surface Area 168.0 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 323.09396
Monoisotopic Mass 323.09396
Heavy Atoms 22
Complexity 423.0

Chemical Identifiers

CAS Number 6336-74-9
SMILES C1=CC=C2C(=C1)C(=C(N2)SCC(C(=O)O)N)C[C@@H](C(=O)O)N
InChIKey MGVCAXMLCYZGFI-RGURZIINSA-N

Product Overview

2-((2-Amino-2-carboxyethyl)thio)tryptophan (CAS 6336-74-9), with molecular formula C14H17N3O4S and molecular weight 323.09396 g/mol. IUPAC: (2S)-2-amino-3-[2-(2-amino-2-carboxyethyl)sulfanyl-1H-indol-3-yl]propanoic acid.

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