0AF

7-hydroxy-L-tryptophan

Created:2007-11-11
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count28
Chiral Atom Count1
Bond Count29
Aromatic Bond Count10
2D diagram of 0AF

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Chemical Component Summary

Name7-hydroxy-L-tryptophan
Systematic Name (OpenEye OEToolkits)(2S)-2-amino-3-(7-hydroxy-1H-indol-3-yl)propanoic acid
FormulaC11 H12 N2 O3
Molecular Weight220.225
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)C(N)Cc2c1cccc(O)c1nc2
SMILESCACTVS3.341N[CH](Cc1c[nH]c2c(O)cccc12)C(O)=O
SMILESOpenEye OEToolkits1.5.0c1cc2c(c[nH]c2c(c1)O)CC(C(=O)O)N
Canonical SMILESCACTVS3.341 N[C@@H](Cc1c[nH]c2c(O)cccc12)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 c1cc2c(c[nH]c2c(c1)O)C[C@@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C11H12N2O3/c12-8(11(15)16)4-6-5-13-10-7(6)2-1-3-9(10)14/h1-3,5,8,13-14H,4,12H2,(H,15,16)/t8-/m0/s1
InChIKeyInChI1.03 VQSRKJZICBNQJG-QMMMGPOBSA-N

Related Resource References

Resource NameReference
PubChem 26338568, 9859285
ChEBI CHEBI:49348