0UO

4-methoxy-L-tryptophan

Created:	2012-06-20
Last modified:	2024-09-27

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2 entries where 0UO is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	1
Bond Count	32
Aromatic Bond Count	10

2D diagram of 0UO

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Chemical Component Summary
Name	4-methoxy-L-tryptophan
Systematic Name (OpenEye OEToolkits)	(2S)-2-azanyl-3-(4-methoxy-1H-indol-3-yl)propanoic acid
Formula	C₁₂ H₁₄ N₂ O₃
Molecular Weight	234.251
Type	PEPTIDE-LIKE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(N)Cc2c1c(cccc1OC)nc2
SMILES	CACTVS	3.370	COc1cccc2[nH]cc(C[CH](N)C(O)=O)c12
SMILES	OpenEye OEToolkits	1.7.6	COc1cccc2c1c(c[nH]2)CC(C(=O)O)N
Canonical SMILES	CACTVS	3.370	COc1cccc2[nH]cc(C[C@H](N)C(O)=O)c12
Canonical SMILES	OpenEye OEToolkits	1.7.6	COc1cccc2c1c(c[nH]2)C[C@@H](C(=O)O)N
InChI	InChI	1.03	InChI=1S/C12H14N2O3/c1-17-10-4-2-3-9-11(10)7(6-14-9)5-8(13)12(15)16/h2-4,6,8,14H,5,13H2,1H3,(H,15,16)/t8-/m0/s1
InChIKey	InChI	1.03	VYXPKRIKQJEAOO-QMMMGPOBSA-N

Related Resource References

Resource Name	Reference
PubChem	86313209, 11218550

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