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89434-12-8 | L-Tryptophan, 5-(acetylamino)-
CAS No: 89434-12-8 Catalog No: AG00441T MDL No:
Product Description
Catalog Number:
AG00441T
Chemical Name:
L-Tryptophan, 5-(acetylamino)-
CAS Number:
89434-12-8
Molecular Formula:
C13H15N3O3
Molecular Weight:
261.2765
IUPAC Name:
3-(5-acetamido-1H-indol-3-yl)-2-aminopropanoic acid
InChI:
InChI=1S/C13H15N3O3/c1-7(17)16-9-2-3-12-10(5-9)8(6-15-12)4-11(14)13(18)19/h2-3,5-6,11,15H,4,14H2,1H3,(H,16,17)(H,18,19)
InChI Key:
GUVVYUMSLQOERS-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
261.281g/mol
Monoisotopic Mass:
261.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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