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148843-41-8 | L-Tryptophan, N-[2-[(hydroxyamino)carbonyl]-3-methyl-1-oxobutyl]-
CAS No: 148843-41-8 Catalog No: AG001L8P MDL No:
Product Description
Catalog Number:
AG001L8P
Chemical Name:
L-Tryptophan, N-[2-[(hydroxyamino)carbonyl]-3-methyl-1-oxobutyl]-
CAS Number:
148843-41-8
Molecular Formula:
C17H21N3O5
Molecular Weight:
347.3657
IUPAC Name:
(2S)-2-[[2-(hydroxycarbamoyl)-3-methylbutanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
InChI:
InChI=1S/C17H21N3O5/c1-9(2)14(16(22)20-25)15(21)19-13(17(23)24)7-10-8-18-12-6-4-3-5-11(10)12/h3-6,8-9,13-14,18,25H,7H2,1-2H3,(H,19,21)(H,20,22)(H,23,24)/t13-,14?/m0/s1
InChI Key:
MIQFXJKPZRPRNQ-LSLKUGRBSA-N
SMILES:
ONC(=O)C(C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C(C)C
Properties
Complexity:
511
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
347.148g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
347.371g/mol
Monoisotopic Mass:
347.148g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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