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5-Bromo-D-tryptophan
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
tryptamine alkaloid
1 reference
based on heuristic
inferred from SMILES
mass
282.000389692
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(S)-2-Amino-3-(5-bromo-1H-indol-3-yl)propanoic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₁BrN₂O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(Cc1c[nH]c2ccc(Br)cc12)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C11H11BrN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m1/s1
0 references
InChIKey
KZDNJQUJBMDHJW-SECBINFHSA-N
0 references
CAS Registry Number
93299-40-2
0 references
PubChem CID
6921694
1 reference
matched by identifier from
InChIKey
InChIKey
KZDNJQUJBMDHJW-SECBINFHSA-N
688350
1 reference
matched by identifier from
InChIKey
InChIKey
KZDNJQUJBMDHJW-SECBINFHSA-N
DSSTox substance ID
DTXSID50350885
1 reference
matched by identifier from
InChIKey
InChIKey
KZDNJQUJBMDHJW-SECBINFHSA-N
DSSTOX compound identifier
DTXCID90301952
0 references
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