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16533-77-0 | Tryptophan, 4-hydroxy-
CAS No: 16533-77-0 Catalog No: AG001W3X MDL No:MFCD17170086
Product Description
Catalog Number:
AG001W3X
Chemical Name:
Tryptophan, 4-hydroxy-
CAS Number:
16533-77-0
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD17170086
IUPAC Name:
2-amino-3-(4-hydroxy-1H-indol-3-yl)propanoic acid
InChI:
InChI=1S/C11H12N2O3/c12-7(11(15)16)4-6-5-13-8-2-1-3-9(14)10(6)8/h1-3,5,7,13-14H,4,12H2,(H,15,16)
InChI Key:
QSHLMQDRPXXYEE-UHFFFAOYSA-N
SMILES:
OC(=O)[C@H](Cc1c[nH]c2c1c(O)ccc2)N
EC Number:
240-605-9
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
99.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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