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Home > Indoles and Oxindole > 2456-73-7
2456-73-7 | L-Aspartic acid, N-[2-(1H-indol-3-yl)acetyl]-
CAS No: 2456-73-7 Catalog No: AG002OJV MDL No:MFCD00079391
Product Description
Catalog Number:
AG002OJV
Chemical Name:
L-Aspartic acid, N-[2-(1H-indol-3-yl)acetyl]-
CAS Number:
2456-73-7
Molecular Formula:
C14H14N2O5
Molecular Weight:
290.2714
MDL Number:
MFCD00079391
IUPAC Name:
(2S)-2-[[2-(1H-indol-3-yl)acetyl]amino]butanedioic acid
InChI:
InChI=1S/C14H14N2O5/c17-12(16-11(14(20)21)6-13(18)19)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)/t11-/m0/s1
InChI Key:
VAFNMNRKDDAKRM-NSHDSACASA-N
SMILES:
O=C(Cc1c[nH]c2c1cccc2)N[C@H](C(=O)O)CC(=O)O
UNII:
5V1L30W0M7
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
290.09g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
290.275g/mol
Monoisotopic Mass:
290.09g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Characterization of an Arabidopsis enzyme family that conjugates amino acids to indole-3-acetic acid. | The Plant cell 20050201 |
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