CAS 57105-42-7 | N-(3-Indolylacetyl)-L-valine | CAS Number 57105-42-7

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Indoles and Oxindole > 57105-42-7

57105-42-7 | N-(3-Indolylacetyl)-L-valine

CAS No: 57105-42-7 Catalog No: AG003SB4 MDL No:MFCD00075402

Product Description

Catalog Number:

AG003SB4

Chemical Name:

N-(3-Indolylacetyl)-L-valine

CAS Number:

57105-42-7

Molecular Formula:

C15H18N2O3

Molecular Weight:

274.3150

MDL Number:

MFCD00075402

IUPAC Name:

(2S)-2-[[2-(1H-indol-3-yl)acetyl]amino]-3-methylbutanoic acid

InChI:

InChI=1S/C15H18N2O3/c1-9(2)14(15(19)20)17-13(18)7-10-8-16-12-6-4-3-5-11(10)12/h3-6,8-9,14,16H,7H2,1-2H3,(H,17,18)(H,19,20)/t14-/m0/s1

InChI Key:

AZEGJHGXTSUPPG-AWEZNQCLSA-N

SMILES:

O=C(Cc1c[nH]c2c1cccc2)N[C@H](C(=O)O)C(C)C

Properties

Complexity:

370

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

274.132g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

274.32g/mol

Monoisotopic Mass:

274.132g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Evaluation of matrix effects in metabolite profiling based on capillary liquid chromatography electrospray ionization quadrupole time-of-flight mass spectrometry.	Analytical chemistry 20070215
Characterization of an Arabidopsis enzyme family that conjugates amino acids to indole-3-acetic acid.	The Plant cell 20050201