2-thio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649)

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CHEBI:74649 - 2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate

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ChEBI ID	CHEBI:74649
ChEBI Name	2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate
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ASCII Name	2-thio-N(6)-L-threonylcarbamoyladenine 5'-monophosphate
Definition	A nucleotide-amino acid that is the N⁶-L-threonylcarbamoyl derivative of 2-thioadenine 5'-monophosphate.
Last Modified	7 January 2015
Submitter	Steve
Downloads	Molfile

Formula	C15H21N6O11PS
Net Charge	0
Average Mass	524.405
Monoisotopic Mass	524.07266
SMILES	C[C@@H](O)[C@H](NC(=O)Nc1nc(S)nc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O)C(=O)O
InChI	InChI=1S/C15H21N6O11PS/c1-4(22)6(13(25)26)17-14(27)18-10-7-11(20-15(34)19-10)21(3-16-7)12-9(24)8(23)5(32-12)2-31-33(28,29)30/h3-6,8-9,12,22-24H,2H2,1H3,(H,25,26)(H2,28,29,30)(H3,17,18,19,20,27,34)/t4-,5-,6+,8-,9-,12-/m1/s1
InChIKey	JDVRDUWFLLUZRR-UEVOLSNJSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
	2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a L-threonine derivative (CHEBI:84189)
	2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a aryl thiol (CHEBI:82711)
	2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a nucleotide-amino acid (CHEBI:48116)
	2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649) is a ureas (CHEBI:47857)
Incoming Relation(s)
Incoming Relation(s)	2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate residue (CHEBI:74648) is substituent group from 2-thio-N⁶-L-threonylcarbamoyladenine 5'-monophosphate (CHEBI:74649)